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• Piceatannol
IUPAC Name: 5-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol | CAS Registry Number: 10083-24-6
Synonyms: piceatannol, astringinin, piceatanol, Astringinine, 3-Hydroxyresveratol, E-Piceatannol, 3'-hydroxyresveratol, demethyl isorhapontigenin, BiomolKI_000023, 3,5,3',4'-Tetrahydroxystilbene, BiomolKI2_000031, RSVL-1, 3,3',4,5'-Stilbenetetrol, 3,3',4,5'-Tetrahydroxystilbene, Lopac0_000915, BSPBio_001120, MLS002153321, 3,3',4'5-Tetrahydroxystilbene, P0453_SIGMA, 3,3',4',5-tetrahydroxystilbene

Molecular Formula: C14H12O4Molecular Weight: 244.242680 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: CDRPUGZCRXZLFL-OWOJBTEDSA-N

• PICROPODOPYHLLIN; (5R,5AS,8AR,9R)-5,8,8A,9-TETRAHYDRO-9-HYDROXY-5-(3,4,5-T RIMETHOXYPHENYL)-FURO[3',4':6,7]NAPHTHO[2,3-D]-1,3-DIOXOL-6(5AH)-ONE
IUPAC Name: (5R,5aR,8aS,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one | CAS Registry Number: 477-47-4
Synonyms: Picropodophyllin, podophyllotoxin, Picropodophyllotoxin, Spectrum_001636, Picropodophyllin (8CI), Spectrum2_000520, Spectrum3_001671, Spectrum4_001836, Spectrum5_000631, IGF-1R Inhibitor, PPP, Ambmdy01504410, BSPBio_003481, KBioGR_002538, KBioSS_002116, NSC36407, SPECTRUM1504410, SPBio_000479, KBio2_002116, KBio2_004684, KBio2_007252

Molecular Formula: C22H22O8Molecular Weight: 414.405280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: YJGVMLPVUAXIQN-HAEOHBJNSA-N

• PIFITHRIN-A HYDROBROMIDE; 1-(4-METHYLPHENYL)-2-(4,5,6,7-TETRAHYDRO-2-IMINO-3(2H)-B ENZOTHIAZOLYL)ETHANONE HYDROBROMIDE
IUPAC Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methylphenyl)ethanone | CAS Registry Number: 63208-82-2
Synonyms: nchembio809-comp3, nchembio790-comp33, Tocris-1267, BSPBio_001026, CBDivE_001116, KBioGR_000366, KBioSS_000366, BCBcMAP01_000143, KBio2_000366, KBio2_002934, KBio2_005502, KBio3_000711, KBio3_000712, CID4817, CHEBI:429136, Bio1_000477, Bio1_000966, Bio1_001455, Bio2_000353, Bio2_000833

Molecular Formula: C16H18N2OSMolecular Weight: 286.391920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OLTZHXYLLRJLST-UHFFFAOYSA-N

• PIFITHRIN-M; 2-PHENYLETHYNESULFONAMIDE
IUPAC Name: 2-phenylethynesulfonamide | CAS Registry Number: 64984-31-2
Synonyms: Pifithrin-mu, nchembio809-comp1, 2-Phenylethynesulfonamide, Phenylacetylenylsulfonamide, Ambcb5147472, Oprea1_468179, Oprea1_544600, P0122_SIGMA, MolPort-000-417-310, NSC303580, HMS1579M04, PFTμ, CID327653, ZINC00164402, NCGC00162358-01, NCGC00162358-02, NCGC00162358-03, BRD-K96799727-001-01-7

Molecular Formula: C8H7NO2SMolecular Weight: 181.211680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZZUZYEMRHCMVTB-UHFFFAOYSA-N

• Pioglitazone HCL
IUPAC Name: 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione hydrochloride | CAS Registry Number: 112529-15-4
Synonyms: Actos, Pioglitazone HCl, Duetact, Glustin, Zactos, Mixture Name, pioglitazone hydrochloride, Actos (TN), C19H20N2O3S.HCl, MLS001306462, MLS001401386, SPECTRUM1504401, Pioglitazone hydrochloride [USAN], U-72107A, CID60560, Pioglitazone hydrochloride (JAN/USP), U-72107E, AD-4833, NCGC00095131-01, NCGC00095131-02

Molecular Formula: C19H21ClN2O3SMolecular Weight: 392.899640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GHUUBYQTCDQWRA-UHFFFAOYSA-N

• Piperine
IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one | CAS Registry Number: 94-62-2
Synonyms: piperine, 1-Piperoylpiperidine, Piperin, Bioperine, Piperoylpiperidine, Piperine (aliphatic), 1-Piperoyl-piperidine, Prestwick_398, piperine, (E,E)-isomer, Prestwick2_000474, Prestwick3_000474, Spectrum5_001507, piperine, (E,Z)-isomer, piperine, (Z,E)-isomer, piperine, (Z,Z)-isomer, FEMA No. 2909, CCRIS 5572, N-[(E,E)-Piperoyl]piperidine, (E,E)-1-piperoylpiperidine, 1-Piperoylpiperidine, (E,E)-

Molecular Formula: C17H19NO3Molecular Weight: 285.337660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MXXWOMGUGJBKIW-YPCIICBESA-N

• PIPLARTINE
IUPAC Name: 1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,3-dihydropyridin-6-one | CAS Registry Number: 20069-09-4
Synonyms: Piperlongumine, Piplartine, Piperlonguminine, Prestwick_399, Prestwick2_000604, Prestwick3_000604, BSPBio_000508, MLS002153903, SPECTRUM1505135, BPBio1_000560, ACon1_001541, CHEBI:564921, MolPort-001-741-398, HMS1569J10, CID637858, ZINC00899053, NCGC00096028-01, NCGC00096028-02, NCGC00096028-03, SMR001233252

Molecular Formula: C17H19NO5Molecular Weight: 317.336460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VABYUUZNAVQNPG-BQYQJAHWSA-N

• Pirfenidone
IUPAC Name: 5-methyl-1-phenylpyridin-2-one | CAS Registry Number: 53179-13-8
Synonyms: Deskar, PIRFENIDONE, Pirespa, Pirfenidone (Deskar), Pirfenidone [USAN:INN], Tocris-1093, Pirfenidonum [INN-Latin], Pirfenidona [INN-Spanish], AMR-69, Lopac-P-2116, AMR 69, Lopac0_000907, MLS000860042, P2116_SIGMA, Pirfenidone (JAN/USAN/INN), C12H11NO, 5-Methyl-1-phenyl-2-(1H)-pyridone, 5-Methyl-1-phenyl-2(1H)-pyridone, Bio1_000397, Bio1_000886

Molecular Formula: C12H11NOMolecular Weight: 185.221840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ISWRGOKTTBVCFA-UHFFFAOYSA-N

• PIT 1
IUPAC Name: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide | CAS Registry Number: 53501-41-0
Synonyms: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide, CBMicro_008144, AC1MUDJ9, PIT-1, STOCK3S-24856, MolPort-000-752-656, SMSF0006015, STL043906, AKOS005697387, MCULE-8548476492, ST097600, BIM-0008258.P001, N-{[(3-chloro-2-hydroxy-5-nitrophenyl)amino]thioxomethyl}benzamide, Benzamide, N-[[(3-chloro-2-hydroxy-5-nitrophenyl)amino]thioxomethyl]-

Molecular Formula: C14H10ClN3O4SMolecular Weight: 351.764900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RIGXBXPAOGDDIG-UHFFFAOYSA-N

• PJ-34
IUPAC Name: 2-(dimethylamino)-N-(6-oxo-5H-phenanthridin-2-yl)acetamide;hydrochloride | CAS Registry Number: 344458-15-7
Synonyms: PARP Inhibitor VIII, PJ34, PJ 34 Hydrochloride, 2-(Dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridin-2-yl)acetamide hydrochloride, PJ34 hydrochloride, SureCN5074001, CTK8E8382, MolPort-003-959-261, s7300, AKOS016012781, QC-8205, AK127264, KB-145973, N-(5,6-Dihydro-6-oxo-2-phenanthridinyl)-2-(dimethylamino)acetamide Hydrochloride, N-(6-Oxo-5,6-dihydrophenanthridin-2-yl)-2-(N,N-dimethylamino)acetamide Hydrochloride

Molecular Formula: C17H18ClN3O2Molecular Weight: 331.796720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: RURAZZMDMNRXMI-UHFFFAOYSA-N

• Plicamycin
IUPAC Name: 2-[4-[4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-3-(3,4-dihydroxy-1-methoxy-2-oxopentyl)-6-[4-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-5-hydroxy-6-methyloxan-2-yl]oxy-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one | CAS Registry Number: 18378-89-7
Synonyms: mithramycin a, plicamycin, Mitramycin, Mithracin, Aureolic acid, Aurelic acid, MITHRAMYCIN, Antibiotic LA 7017, Neuro_000012, NSC24559, CID230076, PA-144, NCGC00181147-01, NCI60_001964, A-2371, 1(2H)-Anthracenone, 6-[[2,6-dideoxy-3-O-(2,6-dideoxy-.beta.-D-arabino-hexo pyranosyl)-.beta.-D-arabino-hexopyranosyl]oxy]-2-[(O-2,6- dideoxy-3-C-methyl-.beta.-D-ribo-hexopyranosyl-(1.fwdarw.4) -O-2,6-dideoxy-.alpha.-D-lyxo-hexopyranosyl-(1.fwdarw.3) -2,6-dideoxy-.beta.-D-arabino-hexopyranosyl)oxy]-3-(3,4- dihydroxy-1-methoxy-2-oxopentyl)-3,4-dihydro-8,9-dihydroxy- 7-methyl-, [2S-[2.alpha.,3.beta.(1R*,3R*,4S*)]]-

Molecular Formula: C52H76O24Molecular Weight: 1085.145440 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 24

InChIKey: CFCUWKMKBJTWLW-UHFFFAOYSA-N

• POLYGODIAL
IUPAC Name: (1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde | CAS Registry Number: 6754-20-7
Synonyms: Polygodial, Poligodial, Tadeonal, (-)-Polygodial, Tadeodal, Drim-7-ene-11,12-dial, (-)-Tadeonal, Epipolygodial, NSC372407, 1,4,4a,5,6,7,8,8a-Octahydro-5,5,8a-trimethyl-1,2-naphthalenedicarboxaldehyde, (1r,4as,8as)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalene-1,2-dicarbaldehyde, 1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-, (1R-(1alpha,4abeta,8aalpha))-, 1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-, (2R,4aS,8aS)-, 1,2-Naphthalenedicarboxaldehyde, 1alpha,4,4aalpha,5,6,7,8,8a-octahydro-5,5,8abata-trimethyl-, 68279-05-0, (+)-Isopetasol, QUIRAL TADEODAL, AC1L2I6W, Ambap6754-20-7, AC1Q6A89

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AZJUJOFIHHNCSV-KCQAQPDRSA-N

• PP1
IUPAC Name: 1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine | CAS Registry Number: 172889-26-8
Synonyms: 1-ter-butyl-3-p-tolyl-1h-pyrazolo[3,4-d]pyrimidin-4-ylamine, 1-(tert-Butyl)-3-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine, 1-tert-butyl-3-(4-methylphenyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine, 1-(tert-butyl)-3-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, Kinome_2004, AC1Q4VDK, BiomolKI_000024, BiomolKI2_000032, SureCN407934, AC1L1BE5, CBiol_001915, Oprea1_734810, BSPBio_001034, KBioGR_000374, KBioSS_000374, ksc-8-189, MLS000326642, BMK1-C12, CHEMBL306380

Molecular Formula: C16H19N5Molecular Weight: 281.355560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZVPDNRVYHLRXLX-UHFFFAOYSA-N

• PR-619
IUPAC Name: (2,6-diamino-5-thiocyanatopyridin-3-yl) thiocyanate | CAS Registry Number: 2645-32-1
Synonyms: Maybridge3_003257, AC1MDW6I, CTK0I6119, HMS1440E01, 3,5-dithiocyanatopyridine-2,6-diamine, QC-8206, IDI1_014644, (2,6-diamino-5-thiocyanatopyridin-3-yl) thiocyanate, Thiocyanic acid, 2,6-diamino-3,5-pyridinediyl ester

Molecular Formula: C7H5N5S2Molecular Weight: 223.278100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ZXOBLNBVNROVLC-UHFFFAOYSA-N

• Proadifen Hydrochloride
IUPAC Name: 2-diethylaminoethyl 2,2-diphenylpentanoate hydrochloride | CAS Registry Number: 62-68-0
Synonyms: Proadifen hydrochloride, Propyladiphenin, proadifen, Proadifen HCl, Prestwick_124, Proafiden hydrochloride, SKF 525A, SKF-525A hydrochloride, SKF-525A, Hydrochloride, SK&F 525-A, MLS000859910, MLS002222169, SKF 525-A, P1061_FLUKA, P1061_SIGMA, SPECTRUM1502084, Proadifen hydrochloride (USAN), Proadifen hydrochloride [USAN], SKF-525A, 302-33-0 (Parent)

Molecular Formula: C23H32ClNO2Molecular Weight: 389.958680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FHIKZROVIDCMJA-UHFFFAOYSA-N

• PTEROSTILBENE(PRIMARY STANDARD)
IUPAC Name: 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol | CAS Registry Number: 537-42-8
Synonyms: Pterostilbene, pterostilben, Pterocarpus marsupium, 3',5'-dimethoxy-resveratrol, MLS000759434, MLS000863581, P1499_SIGMA, 3',5'-Dimethoxy-4-stilbenol, 3,5-Dimethoxy-4'-hydroxystilbene, MEGxp0_000345, 3',5'-dimethoxy-4E-stilbenol, ACon1_000305, CHEBI:237532, MolPort-000-881-877, HMS2051B10, 3',5'-dimethoxy-4trans-stilbenol, CPD-6959, Pterostilbene, Pterocarpus marsupium, LMPK13090015, NSC613735

Molecular Formula: C16H16O3Molecular Weight: 256.296440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VLEUZFDZJKSGMX-ONEGZZNKSA-N

• Punicalagin
Synonyms: GN32, NSC636592, AIDS000462, GN-31, AIDS-000462, 2,3-(S)-Hexahydroxydiphenoyl-4,6-(S,S)-gallagyl-D-glucose

Molecular Formula: C48H28O30Molecular Weight: 1084.717920 [g/mol]
H-Bond Donor: 17H-Bond Acceptor: 30

InChIKey: ZJVUMAFASBFUBG-UHFFFAOYSA-N

• PUROMYCIN AMINONUCLEOSIDE
IUPAC Name: (2R,3R,4S,5S)-4-amino-2-[6-(dimethylamino)purin-9-yl]-5-(hydroxymethyl)oxolan-3-ol | CAS Registry Number: 58-60-6
Synonyms: Aminonucleoside, Puromycin aminonucleoside, ARDMA, Stylomycin aminonucleoside, PANS, Aminonucleoside puromycin, NSC 3056, CHEBI:42839, EINECS 200-388-3, CID6020, NSC3056, MolPort-004-959-753, AIDS000507, C12H18N6O3, 3'-Amino-3'-deoxy-N,N-dimethyladenosine, AIDS-000507, 6-Dimethylamino-9-(3'-ribosylamine)purine, BRN 0093902, 3'-amino-3'-deoxy-n6,n6-dimethyladenosine, LS-15092

Molecular Formula: C12H18N6O3Molecular Weight: 294.309720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: RYSMHWILUNYBFW-GRIPGOBMSA-N

• Puromycin Dihydrochloride
IUPAC Name: (2S)-2-amino-N-[(2S,4R,5R)-5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-(4-methoxyphenyl)propanamide dihydrochloride | CAS Registry Number: 58-58-2
Synonyms: Puromycin hydrochloride, Puromycin dihydrochloride, Puromycin hydrochloride (USAN), CID11953958, C11618, D05655

Molecular Formula: C22H31Cl2N7O5Molecular Weight: 544.431440 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: MKSVFGKWZLUTTO-USYAMCSGSA-N

• PX-866
IUPAC Name: [(3aR,6E,9S,9aR,10R,11aS)-6-[[bis(prop-2-enyl)amino]methylidene]-5-hydroxy-9-(methoxymethyl)-9a,11a-dimethyl-1,4,7-trioxo-2,3,3a,9,10,11-hexahydroindeno[4,5-h]isochromen-10-yl] acetate | CAS Registry Number: 502632-66-8
Synonyms: CHEBI:65345, Sonolisib, Sonolisib [INN], SureCN10020803, CHEMBL411907, DJM-166, DJM-2-166, UNII-987796874T, NSC-722134, (1E,4S,4aR,5R,6aS,9aR)-1-{[di(prop-2-en-1-yl)amino]methylidene}-11-hydroxy-4-(methoxymethyl)-4a,6a-dimethyl-2,7,10-trioxo-1,2,4,4a,5,6,6a,7,8,9,9a,10-dodecahydroindeno[4,5-h]isochromen-5-yl acetate, (4E)-4-(((Bis(prop-2-en-1-yl)amino)methylidene)-6-hydroxy-1alpha-(methoxymethyl)-3,7,17-trioxo-2-oxaandrosta-5,8-dien-11alpha-yl acetate, Cyclopenta(5,6)naphtho(1,2-c)pyran-2,7,10(1H)-trione, 5-(acetyloxy)-1-((di-2-propen-1-ylamino)methylene)-4,4a,5,6,6a,8,9,9a-octahydro-11-hydroxy-4-(methoxymethyl)-4a,6a-dimethyl-, (1E,4S,4ar,5R,6as,9ar)-

Molecular Formula: C29H35NO8Molecular Weight: 525.590100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: QIUASFSNWYMDFS-NILGECQDSA-N

• PYOCYANIN
IUPAC Name: 5-methylphenazin-1-one | CAS Registry Number: 85-66-5
Synonyms: Pyrocyanine, Pyocyanin, Sanasin, Sanazin, PYOCYANINE, Pyocyanine (VAN), 1(5H)-Phenazinone, 5-methyl-, 5-methylphenazin-1(5H)-one, 5-methylphenazin-5-ium-1-olate, CID6817, MolPort-001-781-614, NSC400612, NSC 400612, 1(5H)-Phenazinone, 5-methyl- (VAN), LS-103043, S14-0941, Phenazinium, 1-hydroxy-5-methyl-, hydroxide, inner salt, Phenazinium, 1-hydroxy-5-methyl-, hydroxide, inner salt (8CI)(9CI)

Molecular Formula: C13H10N2OMolecular Weight: 210.231300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YNCMLFHHXWETLD-UHFFFAOYSA-N

• Pyrazino[1',2':1,6]pyrido[3,4-b]indole-3-propanoic acid, 1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-(2-methylpropyl)-1,4-dioxo-, 1,1-dimethylethyl ester, (3S,6S,12aS)-
Synonyms: Ko 143, tert-Butyl 3-((3S,6S,12aS)-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-3-yl)propanoate, Ko-143, Ko143, CHEMBL488910, CTK8C0556, CHEBI:551889, ABP000297, ANW-64890, AKOS016005202, BCP9000818, CS-0298, AK103335, HY-10010, KB-78029, FT-0670686, Ko 143|461054-93-3|Ko143, S14-2693, (3S,6S,12aS)-,2,3,4,6,7,12,12a-Octahydro-9-methoxy-6-(2-methylpropyl)-1,4-dioxopyrazino[1',2':1,6]pyrido[3,4-b]indole-3-propanoic Acid 1,1-Dimethylethyl Ester, (3S,6S,12AS)-1,2,3,4,6,7,12,12A-OCTAHYDRO-9-METHOXY-6-(2-METHYLPROPYL)-1,4-DIOXOPYRAZINO[1',2':1,6]PYRIDO[3,4-B]INDOLE-3-PROPANOIC ACID 1,1-DIMETHYLETHYL ESTER

Molecular Formula: C26H35N3O5Molecular Weight: 469.573200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NXNRAECHCJZNRF-JBACZVJFSA-N

• PYRIDINE, 2,2'-[1,4-PHENYLENEBIS(OXY)]BIS[3,5-DICHLORO-
IUPAC Name: 3,5-dichloro-2-[4-(3,5-dichloropyridin-2-yl)oxyphenoxy]pyridine | CAS Registry Number: 76150-91-9
Synonyms: tcpobop, 1,4-BDPOB, Spectrum5_002035, Lopac-T-1443, CCRIS 3521, BIDD:PXR0116, Lopac0_001174, MLS000532100, T1443_SIGMA, STOCK1S-65264, CID5382, CHEBI:615978, MolPort-000-659-900, 1,4-Bis[2-(3,5-dichloropyridyloxy)]benzene, IN1064, STK018912, ZINC01751810, 1,4-Bis(2-(3,5-dichloropyridyloxy))benzene, NCGC00016001-01, NCGC00016001-02

Molecular Formula: C16H8Cl4N2O2Molecular Weight: 402.058920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BAFKRPOFIYPKBQ-UHFFFAOYSA-N

• Pyridine, 4-[5-(4-Fluorophenyl)-2-[4-(methylsulfinyl)phenyl]-1h-Imidazol-4-Yl]-
IUPAC Name: 4-[4-(4-fluorophenyl)-2-(4-methylsulfinylphenyl)-1H-imidazol-5-yl]pyridine | CAS Registry Number: 152121-47-6
Synonyms: 1pme, Tocris-1202, Tocris-1402, SB 203580, CBiol_001970, BSPBio_001104, nchembio.2007.59-comp4, SB-203580, S8307_SIGMA, SB203580, BIS0733, InSolution™ SB 203580, CHEBI:100250, MolPort-000-006-291, AIDS155260, AIDS220089, Bio1_000256, Bio1_000745, Bio1_001234, AIDS-155260

Molecular Formula: C21H16FN3OSMolecular Weight: 377.434643 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CDMGBJANTYXAIV-UHFFFAOYSA-N

• QUAZINONE
IUPAC Name: 6-chloro-3-methyl-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-2-one | CAS Registry Number: 70018-51-8
Synonyms: quazinone, Quazinonum, Quazinona, Quazinonum [Latin], Quazinona [Spanish], UNII-D1Q7F6C2FP, CID5000, CHEBI:198396, 6-Chloro-3-methyl-1,5-dihydro-imidazo[2,1-b]quinazolin-2-one, 6-Chloro-3-methyl-1,5-dihydro-imidazo[2,1-b]quinazolin-2-one(Quazinone), Imidazo(2,1-b)quinazolin-2(3H)-one, 6-chloro-1,5-dihydro-3-methyl-, (R)-, 105622-85-3

Molecular Formula: C11H10ClN3OMolecular Weight: 235.669600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BHZFZYLBVSWUMT-UHFFFAOYSA-N

• RADICICOL; (1AR,2Z,4E,14R,15AR)-8-CHLORO-1A,14,15,15A-TETRAHYDRO-9,11-DIHYDROXY-14-METHYL-6H-OXIRENO[E][2]BENZOXACYCLOTETRA DECIN-6,12(7H)-DIONE
Synonyms: radicicol, Monorden, NSC294404, Radicicol, Diheterospora chlamydosporia, MONORDEN (B117339F008), (2Z,4E)-8-chloro-9,11-dihydroxy-14-methyl-1a,14,15,15a-tetrahydro-6H-oxireno[e][2]benzoxacyclotetradecine-6,12(7H)-dione

Molecular Formula: C18H17ClO6Molecular Weight: 364.776980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: WYZWZEOGROVVHK-HZDAAVBUSA-N

• RANOLAZINE 99%
IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]acetamide | CAS Registry Number: 142387-99-3
Synonyms: Ranexa, RANOLAZINE, Latixa, Ranolazine 2HCl, (-)-Ranolazine, Ran4, ( -)-Ranolazine, Ranolazine dihydrochloride, Ranexa (TN), RAN D, Ranolazine (USAN/INN), Ambmdy01505366, UNII-A6IEZ5M406, Lopac0_001062, BSPBio_002276, MLS002154149, SPECTRUM1505366, CVT-303, CHEBI:441382, MolPort-003-666-653

Molecular Formula: C24H33N3O4Molecular Weight: 427.536520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: XKLMZUWKNUAPSZ-UHFFFAOYSA-N

• Rapamycin
Synonyms: rapamycin, Sirolimus, Rapamune, 1fkb, 1pbk, LCP-Siro, (-)-Rapamycin, nchembio.79-comp1, nchembio762-comp1, nchembio883-comp3, nchembio.100-comp4, Sirolimus (RAPAMUNE), (-)-Rapamycin;Rapamune, Antibiotic AY 22989, BiomolKI2_000084, nchembio.2007.42-comp2, Sirolimus [USAN:BAN:INN], CCRIS 9024, R0395_SIAL, SILA 9268A

Molecular Formula: C51H79NO13Molecular Weight: 914.171860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 13

InChIKey: QFJCIRLUMZQUOT-HPLJOQBZSA-N

• REPARIXINUM
IUPAC Name: (2R)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfonylpropanamide | CAS Registry Number: 266359-83-5
Synonyms: reparixin, repertaxin, Reparixin [INN], Reparixin (INN/USAN), UNII-U604E1NB3K, CHEBI:416774, CID9838712, 2-(4-isobutylphenyl)propionylmethanesulfonamide, D08984, C490707, (R)-2-(4-isobutylphenyl)propionylmethanesulfonamide, (R)-2-(4-isobutylphenyl)-N-(methylsulfonyl)propanamide, N-[(R)-2-(4-Isobutyl-phenyl)-propionyl]-methanesulfonamide, Benzeneacetamide, alpha-methyl-4-(2-methylpropyl)-N-(methylsulfonyl)-, (alphaR)-

Molecular Formula: C14H21NO3SMolecular Weight: 283.386440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KQDRVXQXKZXMHP-LLVKDONJSA-N

• Resveratrol
IUPAC Name: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol | CAS Registry Number: 501-36-0
Synonyms: resveratrol, trans-resveratrol, (E)-resveratrol, 3,4',5-Stilbenetriol, 3,4',5-Trihydroxystilbene, Prestwick_619, 3,5,4'-Trihydroxystilbene, nchembio.140-comp2, Prestwick2_000508, Prestwick3_000508, Spectrum5_000552, Lopac0_001111, BSPBio_000435, BSPBio_001114, BSPBio_003461, 3,4',5-trihydroxy-stilbene, MLS000069735, MLS001055357, MLS001076538, R5010_SIGMA

Molecular Formula: C14H12O3Molecular Weight: 228.243280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: LUKBXSAWLPMMSZ-OWOJBTEDSA-N

• REVERSINE
IUPAC Name: 6-N-cyclohexyl-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine | CAS Registry Number: 656820-32-5
Synonyms: Reversine, 2vgo, R3904_SIGMA, CHEBI:415813, CID210332, HSCI1_000387, IN1127, NCGC00165880-01, 2-(4-Morpholinoanilino)-6-cyclohexylaminopurine, 1H-Purine-2,6-diamine, N6-cyclohexyl-N2-(4-(4-morpholinyl)phenyl)-, N*6*-Cyclohexyl-N*2*-(4-morpholin-4-yl-phenyl)-9H-purine-2,6-diamine, N6-cyclohexyl-N2-[4-(morpholin-4-yl)phenyl]-9H-purine-2,6-diamine, AD5

Molecular Formula: C21H27N7OMolecular Weight: 393.485380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: ZFLJHSQHILSNCM-UHFFFAOYSA-N

• RHC 80267; O,O'-[1,6-HEXANEDIYLBIS(IMINOCARBONYL)]DIOXIME CYCLOHEXANONE
IUPAC Name: (cyclohexylideneamino) N-[6-[(cyclohexylideneamino)oxycarbonylamino]hexyl]carbamate | CAS Registry Number: 83654-05-1
Synonyms: Quinolyl derivatives, CBiol_002009, Rhc 80267, BSPBio_001074, KBioGR_000414, KBioSS_000414, Rg 80267, RHC-80267, BCBcMAP01_000181, KBio2_000414, KBio2_002982, KBio2_005550, KBio3_000787, KBio3_000788, CID5063, 1,6-Bis(cyclohexyloximinocarbonyl)hexane, CHEBI:364919, MolPort-003-983-840, Bio1_000295, Bio1_000784

Molecular Formula: C20H34N4O4Molecular Weight: 394.508360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: RXSVYGIGWRDVQC-UHFFFAOYSA-N

• Rimonabant(acomplia,SR141716)
IUPAC Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide | CAS Registry Number: 168273-06-1
Synonyms: Rimonabant, Acomplia, Rimoslim, Zimulti, Acomplia (TN), nchembio.129-comp21, Rimonabant (USAN/INN), Rimonabant [USAN:INN], UNII-RML78EN3XE, Bio-0091, CHEBI:116088, AIDS342676, AIDS-342676, SR 141716, CID104850, SR141716A, ZINC01540228, [3H]SR141716A, SR-141716A, A 281

Molecular Formula: C22H21Cl3N4OMolecular Weight: 463.787340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JZCPYUJPEARBJL-UHFFFAOYSA-N

• RK-682
IUPAC Name: (2R)-4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-furan-5-one | CAS Registry Number: 150627-37-5
Synonyms: SureCN4403663, CHEMBL108441, CHEBI:280166, CHEBI:481042, DNC006315, (R)-3-Hexadecanoyl-5-hydroxymethyltetronic acid, (5R)-3-Hexadecanoyl-5-hydroxymethyltetronic acid, (R)-4-Hydroxy-5-(hydroxymethyl)-3-(1-oxohexadecyl)-2(5H)-furanone

Molecular Formula: C21H36O5Molecular Weight: 368.507540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: KZTSLHQKWLYYAC-GOSISDBHSA-N

• Rofecoxib
IUPAC Name: 3-(4-methylsulfonylphenyl)-4-phenyl-2H-furan-5-one | CAS Registry Number: 162011-90-7
Synonyms: rofecoxib, Vioxx, Ceoxx, refecoxib, Vioxx Dolor, Vioxx (trademark), Vioxx (TN), MSD brand of rofecoxib, Spectrum_000119, SpecPlus_000669, Merck brand of rofecoxib, Spectrum2_000446, Spectrum3_001153, Spectrum4_000631, Spectrum5_001598, CCRIS 8967, MK 966, BSPBio_002705, KBioGR_001242, KBioGR_002345

Molecular Formula: C17H14O4SMolecular Weight: 314.355660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RZJQGNCSTQAWON-UHFFFAOYSA-N

• Rolipram
IUPAC Name: 4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-2-one | CAS Registry Number: 61413-54-5
Synonyms: rolipram, Adeo, Rolipramum [Latin], (R)-ROLIPRAM, (R)-(-)-Rolipram, Rolipram [USAN:INN], (+/-)-Rolipram, nchembio.79-comp31, (S)-ROLIPRAM, Prestwick0_000924, Prestwick1_000924, Prestwick2_000924, Prestwick3_000924, UPCMLD-DP110, Lopac0_001072, BSPBio_000828, BSPBio_001356, KBioGR_000076, KBioSS_000076, Rolipram (JAN/USAN/INN)

Molecular Formula: C16H21NO3Molecular Weight: 275.342840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HJORMJIFDVBMOB-UHFFFAOYSA-N

• Rosiglitazone Maleate
IUPAC Name: (Z)-but-2-enedioic acid; 5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione | CAS Registry Number: 155141-29-0
Synonyms: Avandia, Rosiglitazone maleate, rosiglitazone, Avandaryl, Nyracta, Venvia, Mixture Name, Avandia (TN), Rosiglitazone Maleate [USAN], MLS001306472, MLS001401426, BRL 49653C, BRL 49653-C, BRL-49653C, Rosiglitazone maleate (JAN/USAN), C18H19N3O3S.C4H4O4, NSC717764, Avandia administration for 6-12 weeks, CID5281055, CPD000471612

Molecular Formula: C22H23N3O7SMolecular Weight: 473.498920 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: SUFUKZSWUHZXAV-BTJKTKAUSA-N

• Rosmarinic acid
IUPAC Name: (2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid | CAS Registry Number: 20283-92-5
Synonyms: rosmarinic acid, Rosmarinate, Rosmarimic acid, Rosemary acid, (R)-rosmarinic acid, Ambap7578, MLS000697677, 536954_ALDRICH, MEGxp0_000163, ACon1_001068, CHEBI:50371, AIDS026336, AIDS-026336, C18H16O8, 537-15-5 (ROSMARINATE), CID5281792, NCGC00169708-01, SMR000445579, 20283-92-5 (FREE ACID), LS-175479

Molecular Formula: C18H16O8Molecular Weight: 360.314840 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: DOUMFZQKYFQNTF-WUTVXBCWSA-N

• S-Trityl-L-cysteine
IUPAC Name: 2-amino-3-[tri(phenyl)methylsulfanyl]propanoic acid | CAS Registry Number: 2799-07-7
Synonyms: Tritylcysteine, Tritylthioalanine, S-Tritylcysteine, 3-Tritylthio-L-alanine, S-Triphenylmethyl-L-cysteine, L-Alanine, 3-(tritylthio)-, Alanine, 3-(tritylthio)-, L-, Neuro_000036, NCIOpen2_009275, L-Cysteine, S-(triphenylmethyl)-, NSC83265, Alanine, 3-(tritylthio)-, D-, AIDS125757, D-Cysteine, S-(triphenylmethyl)-, AIDS-125757, DL-Cysteine, S-(triphenylmethyl)-, NSC 83265, NSC124663, NSC124676, NSC321080

Molecular Formula: C22H21NO2SMolecular Weight: 363.472640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DLMYFMLKORXJPO-UHFFFAOYSA-N

• SAFRACIN B
Synonyms: Safracin B, Antibiotic EM 5519, Antibiotic Y 16482alpha, Antibiotic Y 16482-alpha, EM 5519, CID160294, LS-119017, Propanamide, 2-amino-N-((6,7,9,10,13,14,14a,15-octahydro-1,7-dihydroxy-2,11-dimethoxy-3,12,16-trimethyl-10,13-dioxo-6,15-imino-5H-isoquino(3,2-b)(3)benzazocin-9-yl)methyl)-, 82029-27-4

Molecular Formula: C28H36N4O7Molecular Weight: 540.608040 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: GKUZBRIJGIGFKC-XPXFATIHSA-N

• SALINOMYCIN MONOSODIUM SALT
IUPAC Name: sodium 2-[6-[6-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.5^{7}.3^{5}]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-5-methyloxan-2-yl]butanoate | CAS Registry Number: 55721-31-8
Synonyms: salinomycin, Coxistal

Molecular Formula: C42H69NaO11Molecular Weight: 772.980430 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 11

InChIKey: YPZYGIQXBGHDBH-UHFFFAOYSA-M

• SALUBRINAL; 3-PHENYL-N-[2,2,2-TRICHLORO-1-[[(8-QUINOLINYLAMINO)THIOX OMETHYL]AMINO]ETHYL]-2-PROPENAMIDE
IUPAC Name: (E)-3-phenyl-N-[2,2,2-trichloro-1-(quinolin-8-ylcarbamothioylamino)ethyl]prop-2-enamide | CAS Registry Number: 405060-95-9
Synonyms: salubrinal, eIF-2alpha Inhibitor, Salubrinal, F0095-1218, BAS 00247559, AC1NX1CD, CHEMBL180127, Salubrinal|405060-95-9, MolPort-001-801-596, STL253110, AKOS000525027, CS-1012, NCGC00159554-01, HY-15486, ST078198, KB-145976, BRD-A77299732-001-01-6, N-(2,2,2-trichloro-1-(3-(quinolin-8-yl)thioureido)ethyl)cinnamamide, (E)-3-phenyl-N-[2,2,2-trichloro-1-(quinolin-8-ylcarbamothioylamino)ethyl]prop-2-enamide, 3-Phenyl-N-[2,2,2-trichloro-1-(3-quinolin-8-yl-thioureido)-ethyl]-acrylamide, (2E)-3-phenyl-N-(2,2,2-trichloro-1-{[(8-quinolylamino)thioxomethyl]amino}ethyl )prop-2-enamide

Molecular Formula: C21H17Cl3N4OSMolecular Weight: 479.809880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: LCOIAYJMPKXARU-VAWYXSNFSA-N

• SB431542
IUPAC Name: 4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzamide | CAS Registry Number: 301836-41-9
Synonyms: SB-431542, SB 431542, 4-(4-(benzo[d][1,3]dioxol-5-yl)-5-(pyridin-2-yl)-1H-imidazol-2-yl)benzamide, SB-431542-A, Bio2_000852, S1067_Selleck, Kinome_3428, PubChem22438, SureCN155156, SureCN310028, AC1ND2U2, BSPBio_001064, KBioGR_000404, KBioSS_000404, CHEMBL440084, QCR-42, BCBcMAP01_000166, CTK8B8498, KBio2_000404, KBio2_002972

Molecular Formula: C22H16N4O3Molecular Weight: 384.387440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FHYUGAJXYORMHI-UHFFFAOYSA-N

• SC-51089
IUPAC Name: 3-chloro-N'-(3-pyridin-4-ylpropanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide;hydrochloride | CAS Registry Number: 146033-02-5
Synonyms: SC 51089, AC1L31IC, SureCN5944364, CHEMBL544573, CTK8F0120, 3-chloro-N'-(3-pyridin-4-ylpropanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide hydrochloride, 8-Chloro-dibenz[b,f][1,4]oxazepine-10(11H)-carboxylic Acid 2-[1-Oxo-3-(4-pyridinyl)propyl]hydrazide Hydrochloride, 8-CHLORODIBENZ[B,F][1,4]OXAZEPINE-10(11H)-CARBOXYLIC ACID 2-[1-OXO-3-(4-PYRIDINYL)PROPYL]HYDRAZIDE HYDROCHLORIDE, Dibenz(b,f)(1,4)oxazepine-10(11H)-carboxylic acid, 8-chloro-, 2-(1-oxo-3-(4-pyridinyl)propyl)hydrazide, monohydrochloride

Molecular Formula: C22H20Cl2N4O3Molecular Weight: 459.325200 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: ORMHJTXDPDGKIS-UHFFFAOYSA-N

• SC-79
IUPAC Name: ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-chromene-3-carboxylate | CAS Registry Number: 305834-79-1
Synonyms: SC79, ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-chromene-3-carboxylate, AC1MDGEE, AOB4998, MolPort-001-841-536, HMS1663O19, SC 79, AKOS024458266, MCULE-7018906021, HY-18749, 2-Amino-6-chloro-?-cyano-3-(ethoxycarbonyl)-4H-1-benzopyran-4-acetic acid ethyl ester, alpha-Cyano-2-amino-3-(ethoxycarbonyl)-6-chloro-4H-1-benzopyran-4-acetic acid ethyl ester

Molecular Formula: C17H17ClN2O5Molecular Weight: 364.780280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: DXVKFBGVVRSOLI-UHFFFAOYSA-N

• SCH 202676 HYDROBROMIDE; N-(2,3-DIPHENYL-1,2,4-THIADIAZOL-5(2H)-YLIDENE)METHANAMI NE HYDROBROMIDE
IUPAC Name: N-methyl-2,3-diphenyl-1,2,4-thiadiazol-5-imine;hydrobromide | CAS Registry Number: 70375-43-8
Synonyms: SCH-202676 hydrobromide, SCH-202676, N-(2,3-Diphenyl-1,2,4-thiadiazol-5-(2H)-ylidene)methanamine, HBr, N-(2,3-diphenyl-1,2,4-thiadiazol-5-(2H)-ylidene)methanamine hydrobromide, N-(2,3-DIPHENYL-1,2,4-THIADIAZOL-5(2H)-YLIDENE)METHANAMINE HYDROBROMIDE, AGN-PC-00IQVQ, MLS002153327, CHEBI:648945, MolPort-003-177-839, AG-G-74777, CCG-222382, LP01078, NCGC00094356-01, NCGC00094356-02, SMR001230740, EU-0101078, S 4063, N-methyl-2,3-diphenyl-1,2,4-thiadiazol-5-imine;hydrobromide

Molecular Formula: C15H14BrN3SMolecular Weight: 348.260760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YJYGOWVFDGULLL-UHFFFAOYSA-N

• SGC 707
IUPAC Name: 1-isoquinolin-6-yl-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea | CAS Registry Number: 1687736-54-4
Synonyms: SGC707, GTPL8552, AOB5757, AKOS025142099, ZINC220951188, CS-5370, HY-19715, 1-isoquinolin-6-yl-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea, 1-Isoquinolin-6-Yl-3-[2-Oxo-2-(Pyrrolidin-1-Yl)ethyl]urea, 1-(Isoquinolin-6-yl)-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl] urea, S7832,1687736-54-4, 3ZG

Molecular Formula: C16H18N4O2Molecular Weight: 298.339720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DMIDPTCQPIJYFE-UHFFFAOYSA-N

• SHZ-1
IUPAC Name: N'-[(Z)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]benzenesulfonohydrazide | CAS Registry Number: 326886-05-9
Synonyms: Shz 1, 2-[(5-Bromo-2-hydroxyphenyl)methylene]hydrazide benzenesulfonic acid

Molecular Formula: C13H11BrN2O3SMolecular Weight: 355.207040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: YFHOVIHRHCFCIR-KTKRTIGZSA-N

• Simvastatin
IUPAC Name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate | CAS Registry Number: 79902-63-9
Synonyms: simvastatin, Zocor, Synvinolin, Sinvacor, Sivastin, Colemin, Medipo, Pantok, Denan, Lipex, Labistatin, Cholestat, Nivelipol, Rendapid, Vasotenal, Coledis, Corolin, Lodales, Simovil, Vytorin

Molecular Formula: C25H38O5Molecular Weight: 418.566220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RYMZZMVNJRMUDD-HGQWONQESA-N

• SINEFUNGIN
IUPAC Name: (2S,5S)-2,5-diamino-6-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanoic acid | CAS Registry Number: 58944-73-3
Synonyms: sinefungin, Sinefungina, Sinefungine, Sinefunginum, Adenosylornithine, 1aqj, 1qaq, Compound 57926, Antibiotic A 9145, Antibiotic 32232 RP, 2h2j, Sinefungine [INN-French], Sinefunginum [INN-Latin], Sinefungina [INN-Spanish], ADENOSYL-ORNITHINE, Sinefungin (USAN/INN), Sinefungin [USAN:INN], UNII-W2U467CIIL, C15H23N7O5, CID65482

Molecular Formula: C15H23N7O5Molecular Weight: 381.387020 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: LMXOHSDXUQEUSF-YECHIGJVSA-N


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