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• Troglitazone
IUPAC Name: 5-[[4-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione | CAS Registry Number: 97322-87-7
Synonyms: troglitazone, Rezulin, Romglizone, Prelay, Romozin, Noscal, Rezulin (TN), Spectrum5_001973, CCRIS 8969, UPCMLD-DP017, Troglitazone [USAN:BAN:INN], CS 045, CS-045, T2573_SIGMA, CI 991, GR 92132X, C24H27NO5S, CHEBI:9753, Troglitazone (JAN/USAN/INN), UPCMLD-DP017:001

Molecular Formula: C24H27NO5SMolecular Weight: 441.539880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GXPHKUHSUJUWKP-UHFFFAOYSA-N

• Troleandomycin
IUPAC Name: [(3R,5S,6S,7R,8S,9R,12R,13S,14R,15R)-6-[(2S,3R,4S,6R)-3-acetyloxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-8-[(2R,4S,5S,6S)-5-acetyloxy-4-methoxy-6-methyloxan-2-yl]oxy-5,7,9,12,13,15-hexamethyl-10,16-dioxo-1,11-dioxaspiro[2.13]hexadecan-14-yl] acetate | CAS Registry Number: 2751-09-9
Synonyms: Oleandocetine, Tribiocillina, Cyclamycin, Evramicina, Matromicina, Treolmicina, Triocetin, Viamicina, Micotil, Triolan, Wytrion, Aovine, TROLEANDOMYCIN, Matromycin T, Treis-Micina, Troleandomicina, Troleandomycine, Oleandocetin, Troleandomycinum, Triacetyloleandomycin

Molecular Formula: C41H67NO15Molecular Weight: 813.968380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 16

InChIKey: LQCLVBQBTUVCEQ-GSELTXNRSA-N

• Tubastatin A hydrochloride
IUPAC Name: N-hydroxy-4-[(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)methyl]benzamide;hydrochloride | CAS Registry Number: 1310693-92-5
Synonyms: Tubastatin A HCl, TSA HCl, 1239262-52-2, cc-256, CS-0498, RL01454, HY-13271, KB-81368, BCP0726000311, X7582, Tubastatin A Hydrochloride|1310693-92-5|TSA HCl, N-hydroxy-4-({2-methyl-1H,3H,4H-pyrido[4,3-b]indol-5-yl}methyl)benzamide hydrochloride, n-hydroxy-4-((1,2,3,4-tetrahydro-2-methyl-5h-pyrido(4,3-b)indol-5-yl)methyl)benzamide hydrochloride

Molecular Formula: C20H22ClN3O2Molecular Weight: 371.860580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: LJTSJTWIMOGKRJ-UHFFFAOYSA-N

• Tunicamycin
IUPAC Name: N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl]-4,5-dihydroxyoxan-3-yl]-12-methyltridec-2-enamide | CAS Registry Number: 11089-65-9
Synonyms: tunicamycin, Tunicamycin A1, CID5607

Molecular Formula: C37H60N4O16Molecular Weight: 816.889500 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 16

InChIKey: YJQCOFNZVFGCAF-UHFFFAOYSA-N

• Tyrphostin AG 879
IUPAC Name: (E)-3-amino-2-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-3-sulfanylprop-2-enenitrile | CAS Registry Number: 148741-30-4
Synonyms: AG 879, AG-879, alpha-Cyano-(3,5-di-t-butyl-4-hydroxy)thiocinnamide, Tyrphostin Ag-879, AC1NUPK6, Lopac-T-2067, BMK1-D4, T2067_SIGMA, CHEMBL539947, MolPort-003-959-688, HMS1361F20, HMS1791F20, HMS3263L11, Tyrphostin AG 879 (AG 879), CCG-100632, NCGC00016007-01, NCGC00016007-02, NCGC00016007-03, NCGC00016007-04, NCGC00016007-05

Molecular Formula: C18H24N2OSMolecular Weight: 316.460960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LCUMYVYIHXYBIA-FOWTUZBSSA-N

• U 18666A
IUPAC Name: 2-(2-diethylaminoethyloxy)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one hydrochloride | CAS Registry Number: 3039-71-2
Synonyms: NSC 70801, CID18224, U18666A, U-18666A, U 18,666A, U-18,666A, LS-186692, 3-beta-(2-(Diethylamino)ethoxy)androst-5-en-17-one, 3-beta-2-Diethylaminoethoxyandrost-5-en-17-one hydrochloride, Androst-5-en-17-one, 3-(2-(diethylamino)ethoxy)-, hydrochloride, (3beta)-, Androst-5-en-17-one, 3beta-(2-(diethylamino)ethoxy)-, hydrochloride, Androst-5-en-17-one, 3beta-(2-(diethylamino)ethoxy)-, hydrochloride (8CI)

Molecular Formula: C25H42ClNO2Molecular Weight: 424.059480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ICPRVJHNLABCSA-UHFFFAOYSA-N

• U-73122 98%
IUPAC Name: 1-[6-[[(8R,9S,13S,14S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]amino]hexyl]pyrrole-2,5-dione | CAS Registry Number: 112648-68-7
Synonyms: U-73122 hydrate, MolMap_000051, BSPBio_001222, U6756_SIGMA, MolPort-003-959-868, Bio1_000364, Bio1_000853, Bio1_001342, CID104794, NCGC00179254-01, LS-184346, U 73122, U-73,122, U73122, U-73122, 1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione, 1H-Pyrrole-2,5-dione, 1-(6-(((17beta)-3-methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-, 1-(6-((17-3-methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione, 1-[6-[((17beta)-3-Methoxyestra-1,3,5[10]-trien-17-yl)amino]hexyl]-1H-pyrrole-2,5-dione

Molecular Formula: C29H40N2O3Molecular Weight: 464.639500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LUFAORPFSVMJIW-ZRJUGLEFSA-N

• U-74389G
IUPAC Name: but-2-enedioic acid;(8S,10S,13S,14S,17S)-17-[2-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]acetyl]-10,13-dimethyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 153190-29-5
Synonyms: u-74389g, CTK8F0276

Molecular Formula: C41H54N6O6Molecular Weight: 726.904060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 12

InChIKey: ABCSSKWSUJMJCP-FRVIMOPGSA-N

• U0126
IUPAC Name: (2Z,3Z)-2,3-bis[amino-(2-aminophenyl)sulfanylmethylidene]butanedinitrile | CAS Registry Number: 109511-58-2
Synonyms: nchembio.282-comp1, BiomolKI_000002, U126 cpd, BiomolKI2_000012, U0126 cpd, BSPBio_001224, CHEBI:150681, AIDS186610, HMS1362N05, HMS1792N05, HMS1990N05, UO126, AIDS-186610, U 0126, UO 126, UO-126, CID3006531, IDI1_002207, SMP2_000197, NCGC00025029-02

Molecular Formula: C18H16N6S2Molecular Weight: 380.489840 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: DVEXZJFMOKTQEZ-JYFOCSDGSA-N

• URB597
IUPAC Name: [3-(3-carbamoylphenyl)phenyl] N-cyclohexylcarbamate | CAS Registry Number: 546141-08-6
Synonyms: FAAH Inhibitor II, URB-597, URB 597, KDS-4103, 3'-Carbamoyl-[1,1'-biphenyl]-3-yl cyclohexylcarbamate, ZINC01238258, ST080941, 3'-Carbamoylbiphenyl-3-yl cyclohexylcarbamate, [3-(3-carbamoylphenyl)phenyl] N-cyclohexylcarbamate, 3′-Carbamoyl-biphenyl-3-yl-cyclohexylcarbamate, Cyclohexyl-carbamic acid 3'-carbamoyl-biphenyl-3-yl ester, URB-597, KDS-4103, 546141-08-6, Cyclohexylcarbamic acid-3′-carbamoyl-biphenyl-3-yl Ester, Carbamic acid, N-cyclohexyl-, 3'-(aminocarbonyl)[1,1'-biphenyl]-3-yl ester, cyclohexyl carbamic acid 3'-carbamoylbiphenyl-3-yl ester, S2631_Selleck, AC1LQWKC, SureCN93842, cc-135, MLS001210199

Molecular Formula: C20H22N2O3Molecular Weight: 338.400280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ROFVXGGUISEHAM-UHFFFAOYSA-N

• Urea, N-[3-(1,1-Dimethylethyl)-1-(4-Methylphenyl)-1h-Pyrazol-5-Yl]-N'-[4-[2-(4-Morpholinyl)ethoxy]-1-Naphthalenyl]-
IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea | CAS Registry Number: 285983-48-4
Synonyms: Doramapimod, nchembio.162-comp7, BIRB-796, 1kv2, UNII-HO1A8B3YVV, Doramapimod (USAN/INN), BIRB 796, CID156422, DB03044, D03736, 1-(5-TERT-BUTYL-2-P-TOLYL-2H-PYRAZOL-3-YL)-3-[4-(2-MORPHOLIN-4-YL-ETHOXY)-NAPHTHALEN-1-YL]-UREA, B96, 1-(3-(1,1-dimethylethyl)-1-(4-methylphenyl)-1H-pyrazol-5-yl)-3-(4-(2-(morpholin-4-yl)ethoxy)naphthalen-1-yl)urea, 1-(5-tert-butyl-2-p-tolyl-2H-pyrazol-3-yl)-3(4-(2-morpholin-4-yl-ethoxy)naphthalen-1-yl)urea, 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea, Urea, N-(3-(1,1-dimethylethyl)-1-(4-methylphenyl)-1H-pyrazol-5-yl)-N'-(4-(2-(4-morpholinyl)ethoxy)-1-naphthalenyl)-

Molecular Formula: C31H37N5O3Molecular Weight: 527.657180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: MVCOAUNKQVWQHZ-UHFFFAOYSA-N

• Valinomycin
IUPAC Name: 2,14,26-trimethyl-5,8,11,17,20,23,29,32,35-nona(propan-2-yl)-3,9,15,21,27,33-hexaoxa-6,12,18,24,30,36-hexazacyclohexatriacontane-1,4,7,10,13,16,19,22,25,28,31,34-dodecone | CAS Registry Number: 2001-95-8
Synonyms: valinomycin, Valinomicin, Antibiotic N-329 B, BSPBio_001226, KBioGR_000566, KBioGR_002478, KBioSS_000566, KBioSS_002485, HSDB 6423, EINECS 217-896-6, KBio2_000566, KBio2_002478, KBio2_003134, KBio2_005046, KBio2_005702, KBio2_007614, KBio3_001011, KBio3_001012, KBio3_002956, CID5649

Molecular Formula: C54H90N6O18Molecular Weight: 1111.321800 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 18

InChIKey: FCFNRCROJUBPLU-UHFFFAOYSA-N

• Valsartan
IUPAC Name: (2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid | CAS Registry Number: 137862-53-4
Synonyms: valsartan, Diovan, Exforge, Mixture Name, Diovan Hct, Diovan (TN), Valsartan [USAN:INN], Spectrum_001796, Spectrum2_001120, Spectrum3_001831, Spectrum4_000749, Spectrum5_001582, BSPBio_003501, KBioGR_001078, KBioSS_002289, MLS000759423, MLS001424088, Valsartan (JAN/USAN/INN), SPECTRUM1505209, SPBio_001260

Molecular Formula: C24H29N5O3Molecular Weight: 435.518760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ACWBQPMHZXGDFX-QFIPXVFZSA-N

• Vanillylidene Acetone
IUPAC Name: (E)-4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one | CAS Registry Number: 1080-12-2
Synonyms: Feruloylmethane, Dehydrozingerone, Vanillalacetone, Vanylidenacetone, dehydrozingerol, Vanillidene acetone, Dehydro(O)-paradol, Vanillylidenacetone, Vanillylidene acetone, (0)-Dehydroparadol, MHSK, (O)-Dehydroparadol, [0]-Dehydroparadol, MMHSK, (O)-Paradol, dehydro-, [0]-Paradol, dehydro-, 3-Methoxy-4-hydroxybenzalacetone, FEMA No. 3738, NSC 4019, NSC 5316

Molecular Formula: C11H12O3Molecular Weight: 192.211180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AFWKBSMFXWNGRE-ONEGZZNKSA-N

• Vatalanib dihydrochloride
IUPAC Name: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine;dihydrochloride | CAS Registry Number: 212141-51-0
Synonyms: Vatalanib, PTK/ZK, CGP-79787D, NCGC00181350-02, PTK/ZK, CGP-79787D, CGP-79787, ZK-222584, 212141-51-0, ZK-222584, Vatalanib 2HCl, Vatalanib succinate, PTK/ZK, CGP-79787D, CGP-79787, ZK-222584, PTK-787, Vatalanib, S1101_Selleck, N-(4-Chlorophenyl)-4-(4-pyridinylmethyl)-1-phthalazinamine Dihydrochloride, SureCN905616, DSSTox_CID_28999, DSSTox_RID_83264, DSSTox_GSID_49073, cc-530, Tox21_113631, AKOS005146306, CS-0149, EX-8584, RL02615

Molecular Formula: C20H17Cl3N4Molecular Weight: 419.734780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: AZUQEHCMDUSRLH-UHFFFAOYSA-N

• Velcade
IUPAC Name: [(1R)-3-methyl-1-[[(2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid | CAS Registry Number: 179324-69-7
Synonyms: Bortezomib, Pyz-Phe-boroLeu, Velcade (TN), DPBA, PROSCRIPT BORONIC ACID, Bortezomib (JAN/USAN/INN), PS-341, Ps 341, LDP-341, LPD 341, LPD-341, MLN-341, AIDS004352, AIDS-004352, CID387447, NSC681239, NSC-681239, NCI60_029010, D03150, BO2

Molecular Formula: C19H25BN4O4Molecular Weight: 384.237200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: GXJABQQUPOEUTA-RDJZCZTQSA-N

• Verapamil Hcl
IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile hydrochloride | CAS Registry Number: 152-11-4
Synonyms: Cardibeltin, Cordilox, Manidon, Verelan, Calan, Cardiabeltin, Cardioprotect, Verapamil HCl, Veroptinstada, Cardiagutt, Durasoptin, Hexasoptin, Veratensin, Berkatens, Calaptin, Corpamil, Dignover, Falicard, Finoptin, Hormitol

Molecular Formula: C27H39ClN2O4Molecular Weight: 491.062560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: DOQPXTMNIUCOSY-UHFFFAOYSA-N

• VERATRAMINE
IUPAC Name: 2-[1-(3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl)ethyl]-5-methylpiperidin-3-ol | CAS Registry Number: 60-70-8
Synonyms: NSC23880, NSC17821, MolPort-001-812-879, AIDS011940, AIDS-011940, CID229854, GPN001245, NCI60_001915, 14,15,16,17-Tetradehydroveratraman-3,23-diol, Veratraman-3,23-diol, 14,15,16,17-tetradehydro-, (3.beta.,23.beta.)-, WLN: L D6 B566 LU&TTTJ A1 E1 OQ FY1&- BT6MTJ CQ E1

Molecular Formula: C27H39NO2Molecular Weight: 409.604060 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: MALFODICFSIXPO-UHFFFAOYSA-N

• Veratridine
Synonyms: veratridine, veratrine, veratridin, 3-Veratroylveracevine, Veratrine (amorphous), nchembio.307-comp12, Veratrine (amorphous) (VAN), BSPBio_001515, HSDB 4078, NSC7524, NSC 7524, CHEBI:28051, EINECS 200-758-4, HMS1989L17, BRN 0078875, CID6914694, NCGC00163144-03, NCI60_041647, LS-162049, 5-21-13-00709 (Beilstein Handbook Reference)

Molecular Formula: C36H51NO11Molecular Weight: 673.790240 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 12

InChIKey: FVECELJHCSPHKY-YFUMOZOISA-N

• Vildagliptin
IUPAC Name: (2R)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile | CAS Registry Number: 274901-16-5
Synonyms: Vildagliptin (JAN/USAN/INN), LS-193227, D07080

Molecular Formula: C17H25N3O2Molecular Weight: 303.399300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SYOKIDBDQMKNDQ-JULPFRMLSA-N

• Vinblastine Sulphate
Synonyms: Velban, Vinblastine sulfate, VLB monosulfate, Velbe, Vinblastine 5, Velsar, Rozevin sulfate, EXAL, Belvan, VLB, Vincaleukoblastine, Velban (TN), Vinblastine sulphate, Exal (TN), Vincaleucoblastine sulfate, Vincaleukoblastine sulfate, Vincaleukoblastine, sulfate, Vinblastine Sulfate Hydrate, Vinblastine, sulfate, hydrate, CCRIS 2584, CHEBI:9984

Molecular Formula: C46H60N4O13SMolecular Weight: 909.052600 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 17

InChIKey: KDQAABAKXDWYSZ-JKDPCDLQSA-N

• Vincristine Sulphate
Synonyms: Oncovin, Kyocristine, Vincrisul, Onkovin, Vincristine sulfate, Vincrex, VCR sulfate, vincristine, Leurocristine, Vincasar PFS, Vincristine sulphate, Oncovin (TN), Leurocristine sulfate, Vincristine, sulfate, Lilly 37231, Leurocristine, sulfate, Vincristinsulfat [German], Ambap1387, Vincristine Sulfate PFS, CCRIS 2583

Molecular Formula: C46H58N4O14SMolecular Weight: 923.036120 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 17

InChIKey: AQTQHPDCURKLKT-JKDPCDLQSA-N

• Vinpocetine
Synonyms: vinpocetine, Cavinton, Bravinton, Ceractin, Ultra-Vinca, Ethyl apovincaminate, Prestwick_963, Ethyl (+)-apovincaminate, Spectrum_001400, Ethyl apovincamin-22-oate, SpecPlus_000327, TCV-3B, Prestwick0_000268, Prestwick1_000268, Prestwick2_000268, Prestwick3_000268, Spectrum2_001529, Spectrum3_000961, Spectrum4_001075, Spectrum5_000966

Molecular Formula: C22H26N2O2Molecular Weight: 350.454040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: DDNCQMVWWZOMLN-IRLDBZIGSA-N

• Vorinostat
IUPAC Name: N'-hydroxy-N-phenyloctanediamide | CAS Registry Number: 149647-78-9
Synonyms: Zolinza, SAHA, SAHA cpd, Vorinostat MSD, suberoylanilide hydroxamic acid, Suberanilohydroxamic acid, M344 compound, Zolinza (TN), Vorinostat (USAN), Vorinostat [USAN], NHNPODA, nchembio815-comp18, N-hydroxy-N'-phenyloctanediamide, 1zz1, CCRIS 8456, MLS001065855, N-Hyrdroxy-N'-phenyloctanediamide, Octanediamide, N-hydroxy-N'-phenyl-, SKI390, N'-hydroxy-N-phenyloctanediamide

Molecular Formula: C14H20N2O3Molecular Weight: 264.320200 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: WAEXFXRVDQXREF-UHFFFAOYSA-N

• Vx-680
IUPAC Name: N-[4-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide | CAS Registry Number: 639089-54-6
Synonyms: Tozasertib, 2f4j, VX-680, MLS001065920, MK-0457, CID5494449, SMR000486395, VX6, Cyclopropanecarboxamide, N-(4-((4-(4-methyl-1-piperazinyl)-6-((5-methyl-1H-pyrazol-3-yl)amino)-2-pyrimidinyl)thio)phenyl)-, Cyclopropanecarboxylic acid N-(4-((4-(4-methylpiperazin-1-yl)-6-(5-methyl-2H-pyrazol-3-ylamino)pyrimidin-2-yl)sulfanyl)phenyl)amide, N-(4-(4-(3-methyl-1H-pyrazol-5-ylamino)-6-(4-methylpiperazin-1-yl)pyrimidin-2-ylthio)phenyl)cyclopropanecarboxamide

Molecular Formula: C23H28N8OSMolecular Weight: 464.586420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: GCIKSSRWRFVXBI-UHFFFAOYSA-N

• Win 55212-2
Synonyms: ( R)-(+)-WIN 55,212-2 mesylate, (R)-(+)-WIN 55,212-2 mesylate salt, WIN 55,212-2 MESYLATE, (R)-(5-Methyl-3-(morpholinomethyl)-2,3-dihydro-[1,4]oxazino[2,3,4-hi]indol-6-yl)(naphthalen-1-yl)methanone methanesulfonate, (R)-(+)-[2,3-Dihydro-5-methyl-3[(4-morpholinyl)methyl]pyrrolo[1,2,3-de]-1,4-benzoxazinyl]-(1-naphthalenyl)methanone mesylate salt, WIN 55,212-2, NCGC00016210-01, Lopac-W-102, WIN 552122 mesylate, WIN55212-2 mesylate, W102_SIGMA, MLS000860027, BML2-C07, CHEMBL1222317, 1-naphthalenyl)methanone mesylate, CTK8B6572, WIN 55212-2 methanesulfonate, HMS2236O05, HMS3267A16, ABP000804

Molecular Formula: C28H30N2O6SMolecular Weight: 522.612600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: FSGCSTPOPBJYSX-VEIFNGETSA-N

• Wortmannin
Synonyms: wortmannin, Wartmannin, wortmanin, nchembio866-comp1, nchembio.117-comp4, Antibiotic SL-2052, nchembio.103-comp11, BSPBio_001232, MLS002703028, W1628_SIGMA, MEGxm0_000446, ACon0_000951, CHEBI:52289, MolPort-001-740-042, N,S-Diacetylcysteine methyl ester, NSC221019, HMS1990N13, CID312145, CPD-11924, ZINC01619592

Molecular Formula: C23H24O8Molecular Weight: 428.431860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: QDLHCMPXEPAAMD-QAIWCSMKSA-N

• WP1130
IUPAC Name: (E)-3-(6-bromopyridin-2-yl)-2-cyano-N-[(1S)-1-phenylbutyl]prop-2-enamide | CAS Registry Number: 856243-80-6
Synonyms: CHEMBL1923233, WP 1130, WP-1130, WP 1130, WP-1130, 856243-80-6, (S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide, WP1130 - Adooq Bioscience, QCR-21, CS-0483, HY-13264, KB-81491, X7509, WP1130|856243-80-6|WP 1130|WP-1130, (2E)-3-(6-bromopyridin-2-yl)-2-cyano-N-[(1S)-1-phenylbutyl]prop-2-enamide

Molecular Formula: C19H18BrN3OMolecular Weight: 384.269720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LIDOPKHSVQTSJY-VMEIHUARSA-N

• XANTHOHUMOL
IUPAC Name: (E)-1-[2,4-dihydroxy-6-methoxy-3-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one | CAS Registry Number: 6754-58-1
Synonyms: Xanthohumol, Desmethylxanthohumol, X0379_SIGMA, MEGxp0_000104, ACon1_001634, CHEBI:521551, MolPort-001-740-284, AIDS188436, AIDS-188436, CID639665, LMPK12120294, Xanthohumol from hop (Humulus lupulus), SMP2_000278, NCGC00180304-01, C16417, C104536, 1-(2,4-Dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl)-3-(4-hydroxyphenyl)-2-propen-1-one, (2E)-1-[2,4-dihydroxy-6-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one, (E)-1-(2,4-dihydroxy-6-methoxy-3-(3-methylbut-2-enyl)phenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, 2-Propen-1-one, 1-(2,4-hydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl)-3-(4-hydroxyphenyl)-, (E)-

Molecular Formula: C21H22O5Molecular Weight: 354.396380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: ORXQGKIUCDPEAJ-YRNVUSSQSA-N

• Z-VAD(OME)-FMK
IUPAC Name: methyl (3S)-5-fluoro-3-[[(2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoyl]amino]-4-oxopentanoate | CAS Registry Number: 187389-52-2
Synonyms: Z-VAD (OMe)-FMK, InSolution™ Caspase Inhibitor I, Z-VAD(OMe)-FMK, Z-Val-Ala-Asp-(OMe)-FMK, Bio2_000471, Z-Val-Ala-Asp-(OMe)-Fluoromethylketone, AC1NUZM6, 5-Bromo-2 -deoxyuridine, Probes1_000501, CBiol_001923, BSPBio_001262, KBioGR_000602, KBioSS_000602, CHEMBL1213366, CTK0I1633, KBio2_000602, KBio2_003170, KBio2_005738, KBio3_001063, KBio3_001064

Molecular Formula: C22H30FN3O7Molecular Weight: 467.487903 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: MIFGOLAMNLSLGH-QOKNQOGYSA-N

• Zafirlukast
IUPAC Name: cyclopentyl N-[3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate | CAS Registry Number: 107753-78-6
Synonyms: zafirlukast, Accolate, Olmoran, Accoleit, Aeronix, Zafirst, Respix, Accolate (TN), Zeneca brand of zafirkulast, Zafirlukast [USAN:BAN:INN], Menarini brand of zafirlukast, Novartis brand of zafirlukast, MLS000759421, MLS001424064, Zafirlukast (JAN/USAN/INN), AstraZeneca brand of zafirlukast, ICI-204219, STOCK6S-45610, C31H33N3O6S, CHEBI:10100

Molecular Formula: C31H33N3O6SMolecular Weight: 575.675220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: YEEZWCHGZNKEEK-UHFFFAOYSA-N

• Zebularine
IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one | CAS Registry Number: 3690-10-6
Synonyms: Pyrimidin-2-one ribonucleoside, Pyrimidin-2-one beta-ribofuranoside, Pyrimidin-2-one beta-D-ribofuranoside, CHEBI:46938, NSC 309132, CID100016, DB03068, NSC-309132, 1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, 1-beta-D-ribofuranosylpyrimidin-2(1H)-one, NCGC00159549-02, 2(1H)-Pyrimidinone, 1-beta-D-ribofuranosyl-, LS-184342, DHZ, 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

Molecular Formula: C9H12N2O5Molecular Weight: 228.201980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RPQZTTQVRYEKCR-WCTZXXKLSA-N

• ZERUMBONE
IUPAC Name: (2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one | CAS Registry Number: 471-05-6
Synonyms: Zerumbone, CHEBI:507810, AIDS051828, AIDS-051828, CPD-11421, NSC698299, CID5470187, LS-58865, 2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one, (E,E,E)-2,6,9,9-Tetramethyl-2,6,10-cycloundecatrien-1-one, 2,6,10-Cycloundecatrien-1-one, 2,6,9,9-tetramethyl-, (E,E,E)-

Molecular Formula: C15H22OMolecular Weight: 218.334580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GIHNTRQPEMKFKO-SKTNYSRSSA-N

• Zileuton
IUPAC Name: 1-[1-(1-benzothiophen-2-yl)ethyl]-1-hydroxyurea | CAS Registry Number: 111406-87-2
Synonyms: ZILEUTON, Zyflo, Leutrol, Zyflo Filmtab, Zyflo CR, Zyflo (TN), Zileutonum [INN-Latin], Abbott 64077, Abbot 64077, Ambap5426, Zileuton (USP/INN), Abbott brand of zileuton, Prestwick0_001090, Zileuton [USAN:BAN:INN], Zileuton [USAN:INN:BAN], MLS000759510, MLS001424079, CTI-02, C11H12N2O2S, CHEBI:10112

Molecular Formula: C11H12N2O2SMolecular Weight: 236.290180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MWLSOWXNZPKENC-UHFFFAOYSA-N

• ZM 306416 HYDROCHLORIDE
IUPAC Name: N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine;hydrochloride | CAS Registry Number: 690206-97-4
Synonyms: 4-[(4'-CHLORO-2'-FLUORO)PHENYLAMINO]-6,7-DIMETHOXYQUINAZOLINE HYDROCHLORIDE, SureCN7867640, ZM 306416 hydrochloride, cc-700, RL04639

Molecular Formula: C16H14Cl2FN3O2Molecular Weight: 370.205663 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SCUXIROMWPQVJO-UHFFFAOYSA-N

• ZM 336372, 98%
IUPAC Name: 3-(dimethylamino)-N-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]benzamide | CAS Registry Number: 208260-29-1
Synonyms: ZM 336372, ZM-336372, ZM336372, n-(5-(3-dimethylaminobenzamido)-2-methylphenyl)-4-hydroxybenzamide, N-[5-(3-Dimethylaminobenzamido)-2-methylphenyl]-4-hydroxybenzamide, 3-(dimethylamino)-N-(3-(4-hydroxybenzamido)-4-methylphenyl)benzamide, 3-(dimethylamino)-N-[3-(4-hydroxybenzamido)-4-methylphenyl]benzamide, Bio1_001346, AC1Q5ECW, BiomolKI_000053, BiomolKI2_000059, cc-52, AC1L1L0E, SureCN1424183, BMK1-F5, BSPBio_001240, KBioGR_000580, KBioSS_000580, CHEMBL186526, CTK8F1043

Molecular Formula: C23H23N3O3Molecular Weight: 389.447020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: PYEFPDQFAZNXLI-UHFFFAOYSA-N

• Zoledronic Acid
IUPAC Name: (1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid | CAS Registry Number: 118072-93-8
Synonyms: Zoledronic acid, Zoledronate, Zometa, Aclasta, Reclast, Bisphosphonate 3, Zometa (Novartis), Zoledronic acid [USAN:INN], STOCK1N-71622, CHEBI:46557, Novartis brand of zoledronic acid, CGP 42446, CGP 42446A, CID68740, CGP-42446, NSC721517, (1-Hydroxy-2-imidazol-1-ylethylidene)diphosphonic acid, CGP 42'446, CGP-42'446, DB00399

Molecular Formula: C5H10N2O7P2Molecular Weight: 272.089622 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: XRASPMIURGNCCH-UHFFFAOYSA-N

• ZPCK
IUPAC Name: benzyl N-[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]carbamate | CAS Registry Number: 26049-94-5
Synonyms: Z-L-Phe chloromethyl ketone, Spectrum2_001493, Spectrum3_001809, Lopac-C-9511, Lopac0_000290, BSPBio_003397, MLS002153274, SPBio_001505, 860794_ALDRICH, KBio3_002900, CHEBI:196054, CID99625, EINECS 247-432-8, ZINC01583409, NSC 251810, NCGC00015284-01, NCGC00093742-01, NCGC00093742-02, NCGC00093742-03, SMR001230710

Molecular Formula: C18H18ClNO3Molecular Weight: 331.793420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OYHLRJGDELITAF-INIZCTEOSA-N

• Zstk474
IUPAC Name: 4-[4-[2-(difluoromethyl)benzimidazol-1-yl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine | CAS Registry Number: 475110-96-4
Synonyms: ZSTK474, ZSTK-474, 4,4'-(6-(2-(Difluoromethyl)-1H-benzo[d]imidazol-1-yl)-1,3,5-triazine-2,4-diyl)dimorpholine, ZSTK 474, TCMDC-137004, ZSTK-474, ZST K474, 475110-96-4, ZSTK-474, ZSTK474, 2wxl, S1072_Selleck, PubChem22461, AGN-PC-00DCQP, SureCN373282, cc-503, UNII-K0068GK39A, CHEMBL586702, QCR-72, ZSTK474/ZSTK-474, CTK8B6247, CHEBI:628559, MolPort-009-199-495

Molecular Formula: C19H21F2N7O2Molecular Weight: 417.412546 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: HGVNLRPZOWWDKD-UHFFFAOYSA-N

• (-)-Actinonin
IUPAC Name: (2R)-N'-hydroxy-N-[(2S)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-pentylbutanediamide | CAS Registry Number: 13434-13-4
Synonyms: actinonin, Actinonine, Spectrum2_000628, Spectrum3_000680, Spectrum4_001932, Spectrum5_000728, Lopac0_000010, BSPBio_002379, KBioGR_002305, DivK1c_001024, SPBio_000596, KBio1_001024, KBio3_001599, NINDS_001024, AIDS110792, C19H35N3O5, AIDS-110792, CID443600, CPD0-1358, IDI1_001024

Molecular Formula: C19H35N3O5Molecular Weight: 385.498300 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: XJLATMLVMSFZBN-VYDXJSESSA-N

• 1-(3,6-Dibromo-9H-carbazol-9-yl)-3-(dimethylamino)propan-2-ol
IUPAC Name: 1-(3,6-dibromocarbazol-9-yl)-3-(dimethylamino)propan-2-ol | CAS Registry Number: 253449-04-6
Synonyms: Wiskostatin, (S)-WISKOSTATIN, Maybridge1_002006, Oprea1_105682, Oprea1_198540, BSPBio_001280, CBDivE_008357, KBioGR_000620, KBioSS_000620, BCBcMAP01_000077, KBio2_000620, KBio2_003188, KBio2_005756, KBio3_001099, KBio3_001100, Bio2_000480, Bio2_000960, CID2775510, DB01731, IDI1_002235

Molecular Formula: C17H18Br2N2OMolecular Weight: 426.145620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XUBJEDZHBUPBKL-UHFFFAOYSA-N

• 3-Pyridinecarbonitrile, 6-[[2-[[4-(2,4-Dichlorophenyl)-5-(5-Methyl-1h-Imidazol-2-Yl)-2-Pyrimidinyl]amino]ethyl]amino]-
IUPAC Name: 6-[2-[[4-(2,4-dichlorophenyl)-5-(5-methyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethylamino]pyridine-3-carbonitrile | CAS Registry Number: 252917-06-9
Synonyms: CHIR99021, CHIR-99021, CHIR 99021, CT-99021, 6-[2-[4-(2,4-Dichlorophenyl)-5-(4-methyl-1H-imidazol-2-yl)pyrimidin-2-ylamino]ethylamino]pyridine-3-carbonitrile, CT99021, 252917-06-9, 3-PYRIDINECARBONITRILE, 6-[[2-[[4-(2,4-DICHLOROPHENYL)-5-(5-METHYL-1H-IMIDAZOL-2-YL)-2-PYRIMIDINYL]AMINO]ETHYL]AMINO]-, CT-99021, CHIR99021, CHIR-99021, 3-Pyridinecarbonitrile, 6-((2-((4-(2,4-dichlorophenyl)-5-(5-methyl-1H-imidazol-2-yl)-2-pyrimidinyl)amino)ethyl)amino)-, S1263_Selleck, Kinome_3785, CT 99021, GSK-3 Inhibitor XVI, cc-59, SureCN151139, SureCN240280, UNII-234CMT4GK4, CHEMBL412142, CHIR-911, CTK4F5391

Molecular Formula: C22H18Cl2N8Molecular Weight: 465.337920 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: AQGNHMOJWBZFQQ-UHFFFAOYSA-N

• 4h-1-Benzopyran-4-One, 2-(2-Amino-3-Methoxyphenyl)-
IUPAC Name: 2-(2-amino-3-methoxyphenyl)chromen-4-one | CAS Registry Number: 167869-21-8
Synonyms: Tocris-1213, Lopac-P-215, BiomolKI_000001, BiomolKI2_000011, P215_SIGMA, Lopac0_001028, BSPBio_000996, KBioGR_000336, KBioSS_000336, PD 98059, BCBcMAP01_000049, KBio2_000336, KBio2_002904, KBio2_005472, KBio3_000671, KBio3_000672, BIP0711, CID4713, PD 98,059, AIDS220091

Molecular Formula: C16H13NO3Molecular Weight: 267.279320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QFWCYNPOPKQOKV-UHFFFAOYSA-N

• 3-Cyano-7-Ethoxycoumarin
IUPAC Name: 7-ethoxy-2-oxochromene-3-carbonitrile | CAS Registry Number: 117620-77-6
Synonyms: 3-Cetc, 3-Cyano-7-ethoxycoumarin, UC455_SIGMA, Oprea1_543395, C2612_SIGMA, 7-Ethoxycoumarin-3-carbonitrile, 04141_FLUKA, ZINC00058011, CID164045, NCGC00165764-01, NCGC00165764-02, 2H-1-Benzopyran-3-carbonitrile, 7-ethoxy-2-oxo-

Molecular Formula: C12H9NO3Molecular Weight: 215.204760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YAFGHMIAFYQSCF-UHFFFAOYSA-N

• 1-[(2-Phenylethyl)amino]-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Synonyms: BAS 05532738, ZINC00794937, AC1LL8AQ, ChemDiv3_007227, Oprea1_487649, STOCK5S-38088, CTK8F0265, MolPort-000-628-443, MolPort-005-971-412, HMS1493I11, BRD 7389, STK874273, AKOS000594176, CCG-120899, MCULE-4982114754, IDI1_025137, BRD-K15107389-001-01-0, 1-Phenethylamino-3H-naphtho[1,2,3-de]quinoline-2,7-dione, 1-[(2-phenylethyl)amino]-3H-naphtho[1,2,3-de]quinoline-2,7-dione

Molecular Formula: C24H18N2O2Molecular Weight: 366.411920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XASCINRGTHLHGM-UHFFFAOYSA-N

• (L-3-Trans-Carboxyoxirane-2-Carbonyl)-L-Leucylagmatine Hemihydrate
IUPAC Name: (2R,3R)-3-[[(2S)-1-[4-(diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid | CAS Registry Number: 66701-25-5
Synonyms: e-64, Thiol protease inhibitor, Lopac-E-3132, MLS000069547, MLS002153455, E3132_SIGMA, 45370_FLUKA, AIDS059870, AIDS-059870, CID439487, NCGC00015406-01, NCGC00015406-02, SMR000058838, C01341, trans-Epoxysuccinyl-L-leucylamido(4-guanidino)butane, L-trans-3-Carboxyoxiran-2-carbonyl-L-leucylagmatine, N-(trans-Epoxysuccinyl)-L-leucine 4-guanidinobutylamide

Molecular Formula: C15H27N5O5Molecular Weight: 357.405380 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: LTLYEAJONXGNFG-HBNTYKKESA-N

• 7-CHLORO-5-(2-CHLOROPHENYL)-1,5-DIHYDRO-4,1-BENZOTHIAZEPIN-2(3H)-ONE
IUPAC Name: 7-chloro-5-(2-chlorophenyl)-1,5-dihydro-4,1-benzothiazepin-2-one | CAS Registry Number: 75450-34-9
Synonyms: BSPBio_001556, KBioGR_000276, KBioSS_000276, KBio2_000276, KBio2_002844, KBio2_005412, KBio3_000551, KBio3_000552, CID2688, CGP-37157, MolPort-003-983-535, Bio1_000408, Bio1_000897, Bio1_001386, Bio2_000276, Bio2_000756, HMS1989N18, CGP 37157, HSCI1_000330, IDI1_034026

Molecular Formula: C15H11Cl2NOSMolecular Weight: 324.224940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KQEPIRKXSUIUTH-UHFFFAOYSA-N

• 1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazin-2-ylmethyl)- 4,9-dihydro-1H-naphtho[2,3-d]imidazolium bromide
IUPAC Name: 1-(2-methoxyethyl)-2-methyl-3-(pyrazin-2-ylmethyl)benzo[f]benzimidazol-3-ium-4,9-dione;bromide | CAS Registry Number: 781661-94-7
Synonyms: Sepantronium bromide, YM-155, 4,9-Dihydro-1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(2-pyrazinylmethyl)-1H-naphth[2,3-d]imidazolium bromide, UNII-7H5Q4J1CM5, CHEMBL2105734, MolPort-021-805-026, Sepantronium bromide (JAN/USAN), Sepantronium bromide [USAN:INN], BCPP000007, ABP000261, CS-0336, RL05028, HY-10194, KB-26636, FT-0660380, X7538, A25644, D10164, YM-155|781661-94-7|Sepantronium bromide|YM 155, 1H-Naphth(2,3-d)imidazolium, 4,9-dihydro-1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazinylmethyl)-, bromide

Molecular Formula: C20H19BrN4O3Molecular Weight: 443.293860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: QBIYUDDJPRGKNJ-UHFFFAOYSA-M

• 1-Benzoyl-3-phenyl-2-thiourea
IUPAC Name: N-(phenylcarbamothioyl)benzamide | CAS Registry Number: 4921-82-8
Synonyms: Phenyl benzoyl thiourea, WLN: SUYMR&MVR, CBMicro_019876, USAF K-1473, Benzamide, N-phenylthiocarbamoyl-, N-Benzoyl-N'-phenylthiourea, NSC 5817, NSC5817, UREA, 1-BENZOYL-3-PHENYL-2-THIO-, AI3-24581, Benzamide, N-[(phenylamino)thioxomethyl]-, Benzamide, N-((phenylamino)thioxomethyl)-, BIM-0020150.P001, LS-158926, ST5035646, Benzamide, N-((phenylamino)thioxomethyl)- (9CI), SR-01000635902-1

Molecular Formula: C14H12N2OSMolecular Weight: 256.322880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: GVHZQIIMGRLFMX-UHFFFAOYSA-N

• 2-N-Hexyl-4-pentynoic acid
IUPAC Name: 2-prop-2-ynyloctanoic acid | CAS Registry Number: 96017-59-3

Molecular Formula: C11H18O2Molecular Weight: 182.259420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DUQSBRQHALCSLC-UHFFFAOYSA-N


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