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• N-OCTANOYLSPHINGOSINE,D-ERYTHRO
IUPAC Name: N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]octanamide | CAS Registry Number: 74713-59-0
Synonyms: C8 ceramide, D-erythro-Sphingosine, N-Octanoyl-, N-octanoylsphingosine, AC1NWBN3, N-Octanoyl-D-sphingosine, BSPBio_001569, O1882_SIGMA, BML3-D01, CHEMBL444463, N-octanoyl-D-erythro-sphingosine, CHEBI:45815, MolPort-003-845-711, HMS1361O11, HMS1791O11, HMS1989O11, C8 Ceramide (d18:1/8:0), IDI1_034039, NCGC00161360-01, NCGC00161360-02, NCGC00161360-03

Molecular Formula: C26H51NO3Molecular Weight: 425.688040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: APDLCSPGWPLYEQ-WRBRXSDHSA-N

• N-PHENYL-4-(3-PHENYL-1,2,4-THIADIAZOL-5-YL)-1-PIPERAZINECARBOXAMIDE
IUPAC Name: N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide | CAS Registry Number: 681136-29-8
Synonyms: JNJ-1661010, JNJ 1661010, AG-G-59868, 1-Piperazinecarboxamide, N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)-, N1-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide, N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide, ZINC01028145, ACMC-20emff, AC1MDCTI, AC1Q5LMB, SureCN1164398, Oprea1_746619, MLS001111246, CHEMBL460273, UNII-62521S57AU, CTK1J2536, CHEBI:550555, MolPort-001-806-365, HMS1662H10, HMS2801K13

Molecular Formula: C19H19N5OSMolecular Weight: 365.452060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: BHBOSTKQCZEAJM-UHFFFAOYSA-N

• N2-[4-(AMINOMETHYL)PHENYL]-5-FLUORO-N4-PHENYLPYRIMIDINE-2,4-DIAMINE
IUPAC Name: 2-N-[4-(aminomethyl)phenyl]-5-fluoro-4-N-phenylpyrimidine-2,4-diamine | CAS Registry Number: 916603-07-1
Synonyms: N2-(4-(Aminomethyl)phenyl)-5-fluoro-N4-phenylpyrimidine-2,4-diamine, N2-[4-(Aminomethyl)phenyl]-5-fluoro-N4-phenylpyrimidine-2,4-diamine, AGN-PC-00QPJR, SureCN4276330, CHEBI:39072, CTK5H0282, ABP000511, ANW-67911, RS0108, AKOS016006994, AG-H-76435, AK-80985, KB-258532, FT-0661935, 2,4-Pyrimidinediamine, N2-[4-(aminomethyl)phenyl]-5-fluoro-N4-phenyl-, N(2)-[4-(aminomethyl)phenyl]-5-fluoro-N(4)-phenylpyrimidine-2,4-diamine, N2-[4-(Aminomethyl)phenyl]-5-fluoro-N4-phenyl-2,4-pyrimidinediamine

Molecular Formula: C17H16FN5Molecular Weight: 309.340843 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: UKOHFWNBTUJMMN-UHFFFAOYSA-N

• Nafamostat mesylate
IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) 4-(diaminomethylideneamino)benzoate; methanesulfonic acid | CAS Registry Number: 82956-11-4
Synonyms: Futhan, Nafamstat, Ronastat, nafamostat mesilate, Nafamstat Mesilate, Ronastat (TN), Nafamostat mesilate (JAN), Nafamostat mesylate (USAN), FUT-175, CID5311180, D01670, 6-Amidino-2-naphthyl-4-guanidinobenzoate Dimethanesulfonate

Molecular Formula: C21H25N5O8S2Molecular Weight: 539.581900 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 13

InChIKey: SRXKIZXIRHMPFW-UHFFFAOYSA-N

• Nalmefene HCL
Synonyms: Revex, Nalmefene hydrochloride, Revex (TN), LS-183737, D02104, 17-(Cyclopropylmethyl)-4,5alpha-epoxy-6-methylenemorphinan-3,14-diol, , hydrochloride, Morphinan-3,14-diol, 17-(cyclopropylmethyl)-4,5-epoxy-6-methylene-, hydrochloride, (5alpha)-, 55096-26-9

Molecular Formula: C21H26ClNO3Molecular Weight: 375.889040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: GYWMRGWFQPSQLK-OPHZJPRHSA-N

• Naloxone Hydrochloride
Synonyms: Narcan, Naloxone hydrochloride, naloxone, Nalonee, Naloxone HCl, Prestwick_879, Narcan (TN), MLS000069540, N7758_SIGMA, UNII-F850569PQR, Naloxone hydrochloride dihydrate, 465-65-6 (Parent), NIH 7890, EINECS 206-611-0, Naloxone hydrochloride (JP15/USP), CID5464092, SMR000058766, D01340, l-N-Allyl-14-hydroxynordihydromorphinone hydrochloride, (5alpha)-17-Allyl-4,5-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride

Molecular Formula: C19H22ClNO4Molecular Weight: 363.835280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RGPDIGOSVORSAK-STHHAXOLSA-N

• Nalpha-4-Tosyl-L-arginine methyl ester hydrochloride
IUPAC Name: methyl 5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate hydrochloride | CAS Registry Number: 1784-03-8
Synonyms: EINECS 217-235-1, CID3083734, Methyl N2-((p-tolyl)sulphonyl)-L-argininate monohydrochloride

Molecular Formula: C14H23ClN4O4SMolecular Weight: 378.874820 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: JIQFFACVQXXHMY-UHFFFAOYSA-N

• Natamycin
Synonyms: pimaricin, NATAMYCIN, Natamycin preparation, Pimaricin preparation, MLS000759475, P0440_SIGMA, P9703_SIGMA, 80482_FLUKA, SMR000466358, (1R,3S,5R,7R,8E,12R,14E,16E,18E,20E,22R,24S,25R,26S)-22-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,26-trihydroxy-12-methyl-10-oxo-6,11,28-trioxatricyclo[22.3.1.0~5,7~]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid

Molecular Formula: C33H47NO13Molecular Weight: 665.725180 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 14

InChIKey: NCXMLFZGDNKEPB-FFPOYIOWSA-N

• NECROSTATIN 2 (RACEMATE), 98%
IUPAC Name: 5-[(7-chloro-1H-indol-3-yl)methyl]-3-methylimidazolidine-2,4-dione | CAS Registry Number: 852391-15-2
Synonyms: Necrostatin 2 racemate, 5-((7-chloro-1H-indol-3-yl)methyl)-3-methylimidazolidine-2,4-dione, 5-[(7-chloro-1H-indol-3-yl)methyl]-3-methylimidazolidine-2,4-dione, AC1LD8BC, SCHEMBL859956, CHEMBL381230, HY-14622A, NSC745841, CS-1664, NSC-745841, AK173557, KB-269463, 5-((7-cl-1h-indol-3-yl)methyl)-3-methylimidazolidine-2,4-dione)

Molecular Formula: C13H12ClN3O2Molecular Weight: 277.706280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WIKGAEMMNQTUGL-UHFFFAOYSA-N

• NEURODAZINE; 2-[5-(3-CHLOROPHENYL)FURAN-2-YL]-4,5-BIS(4-METHOXYPHENYL)-1H-IMIDAZOLE
IUPAC Name: 2-[5-(3-chlorophenyl)furan-2-yl]-4,5-bis(4-methoxyphenyl)-1H-imidazole | CAS Registry Number: 937807-66-4
Synonyms: Neurodazine, SureCN12869707, CTK8E8872, MolPort-009-019-497, ZINC35261438, 2-[5-(3-Chlorophenyl)-2-furanyl]-4,5-bis(4-methoxyphenyl)-1H imidazole

Molecular Formula: C27H21ClN2O3Molecular Weight: 456.920240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FEEOFPAEDSMOTO-UHFFFAOYSA-N

• Nicardipine Hydrochloride
IUPAC Name: 3-O-[2-[benzyl(methyl)amino]ethyl] 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate hydrochloride | CAS Registry Number: 54527-84-3
Synonyms: Cardene, Perdipine, Nicodel, Loxen, Angioglebil, Bionicard, Nicardil, Perdipina, Lincil, Dafil, Dagan, Antagonil, Nerdipine, Perpidine, Nicardipine HCl, NICARDIPINE HYDROCHLORIDE, Cardene SR, Prestwick_590, Cardene (TN), MLS000069782

Molecular Formula: C26H30ClN3O6Molecular Weight: 515.985900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: AIKVCUNQWYTVTO-UHFFFAOYSA-N

• Niclosamide
IUPAC Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide | CAS Registry Number: 50-65-7
Synonyms: niclosamide, Niclocide, Bayluscid, Devermine, Dichlosale, Helmiantin, Tredemine, Cestocid, Devermin, Mansonil, Phenasal, Radeverm, Vermitid, Vermitin, Atenase, Fenasal, Iomesan, Iomezan, Sagimid, Yomesan

Molecular Formula: C13H8Cl2N2O4Molecular Weight: 327.119620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RJMUSRYZPJIFPJ-UHFFFAOYSA-N

• Nifedipine
IUPAC Name: dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 21829-25-4
Synonyms: nifedipine, Procardia, Corinfar, Adalat, Cordipin, Procardia XL, Fenihidine, Fenihidin, Citilat, Oxcord, Adalat CC, Cordipine, Fenigidin, Korinfar, Nifangin, Adalate, Dignokonstant, Cardionorm, Chronadalate, Adapress

Molecular Formula: C17H18N2O6Molecular Weight: 346.334620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: HYIMSNHJOBLJNT-UHFFFAOYSA-N

• Nigericin sodium salt
IUPAC Name: sodium 2-[(3S,6R)-6-[[(5R,7R,9R,10R)-2-[5-[(3S,5R)-5-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-9-methoxy-2,4,10-trimethyl-1,6-dioxaspiro[4.5]decan-7-yl]methyl]-3-methyloxan-2-yl]propanoate | CAS Registry Number: 28643-80-3
Synonyms: nigericin, Nigericin sodium, Sodium nigericin, NIGERICIN, MONOSODIUM SALT, CID34297, NSC 292567

Molecular Formula: C40H67NaO11Molecular Weight: 746.943150 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: MOYOTUKECQMGHE-KKCUGXASSA-M

• NIGULDIPINE HCL
IUPAC Name: 5-O-[3-(4,4-diphenylpiperidin-1-yl)propyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride | CAS Registry Number: 113317-61-6
Synonyms: NSC-617553, niguldipine hydrochloride, DSSTox_CID_26318, DSSTox_RID_81534, DSSTox_GSID_46318, 119934-51-9, (+/-) -Niguldipine hydrochloride (1:x), CAS-102992-93-8, B-844-39, S-(+)-Niguldipine hydrochloride, (R)-(-)-Niguldipine hydrochloride, Dexniquldipine HCl, 113145-70-3, Niguldipine hydrochloride, (+/-)-, Niguldipine ?HCl, AC1L7BH8, SCHEMBL9001404, CHEMBL1965632, DTXSID20872307, MHOSUIMBPQVOEU-UHFFFAOYSA-N

Molecular Formula: C36H40ClN3O6Molecular Weight: 646.181 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: MHOSUIMBPQVOEU-UHFFFAOYSA-N

• Nilvadipine
IUPAC Name: 3-O-methyl 5-O-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 75530-68-6
Synonyms: nilvadipine, Nivadil, Nivadipine, Escor, Nilvadipinum [Latin], Nilvadipino [Spanish], Nivadil (TN), Nilvadipine [USAN:INN:JAN], Nilvadipine (JP15/USAN/INN), FK 235, C19H19N3O6, BRN 3572609, FK-235, FR 34235, FR-34235, SK&F 102,362, SK&F-102362, CL 287,389, NCGC00167435-01, CL-287389

Molecular Formula: C19H19N3O6Molecular Weight: 385.370660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: FAIIFDPAEUKBEP-UHFFFAOYSA-N

• Nitrendipine
IUPAC Name: 3-O-ethyl 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 39562-70-4
Synonyms: nitrendipine, Baypress, Bayotensin, Nidrel, Nitrendimerck, Baylotensin, Nitregamma, Nitrendepat, Nitrendidoc, Nitrendipin, Nitrepress, Tensogradal, Vastensium, Balminil, Baypresol, Jutapress, Nitrensal, Trendinol, Gericin, Niprina

Molecular Formula: C18H20N2O6Molecular Weight: 360.361200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: PVHUJELLJLJGLN-UHFFFAOYSA-N

• Nobiletin
IUPAC Name: 2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one | CAS Registry Number: 478-01-3
Synonyms: Hexamethoxyflavone, Flavonoid, Spectrum2_001697, Spectrum3_000921, Spectrum4_001020, KBioGR_001519, MLS000574877, MLS000759462, MLS000877030, SPECTRUM1505268, SPBio_001654, CCRIS 9012, MEGxp0_000930, NSC76751, ACon1_000921, KBio3_001922, NSC 76751, AIDS003056, AIDS-003056, C21H22O8

Molecular Formula: C21H22O8Molecular Weight: 402.394580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: MRIAQLRQZPPODS-UHFFFAOYSA-N

• Nocodazole
IUPAC Name: methyl N-[6-(thiophene-2-carbonyl)-1H-benzimidazol-2-yl]carbamate | CAS Registry Number: 31430-18-9
Synonyms: nocodazole, Oncodazole, Nocodazolum, Nocidazole, Nocodazol, Prestwick_359, nchembio.63-comp4, nchembio.100-comp7, nchembio.90-comp11, Nocodazol [INN-Spanish], Nocodazolum [INN-Latin], Tocris-1228, Nocodazole (USAN/INN), Nocodazole [USAN:INN], Prestwick0_000100, Prestwick1_000100, Prestwick2_000100, Prestwick3_000100, Spectrum3_001768, Spectrum4_001060

Molecular Formula: C14H11N3O3SMolecular Weight: 301.320440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KYRVNWMVYQXFEU-UHFFFAOYSA-N

• NPC-15437 DIHYDROCHLORIDE SELECTIVE PROT EIN KIN
IUPAC Name: 2,6-diamino-N-[[(2S)-1-tridecanoylpiperidin-2-yl]methyl]hexanamide;hydrate;dihydrochloride | CAS Registry Number: 141774-20-1

Molecular Formula: C25H54Cl2N4O3Molecular Weight: 529.627260 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 5

InChIKey: GTFUFMLQSIAASY-HTJANFELSA-N

• Nsc 23766 Tetrahydrochloride
IUPAC Name: 6-N-[2-[5-(diethylamino)pentan-2-ylamino]-6-methylpyrimidin-4-yl]-2-methylquinoline-4,6-diamine;hydrochloride | CAS Registry Number: 733767-34-5
Synonyms: Nsc 23766, NSC-23766, cc-673, 6-N-[2-[5-(diethylamino)pentan-2-ylamino]-6-methylpyrimidin-4-yl]-2-methylquinoline-4,6-diamine trihydrochloride

Molecular Formula: C24H36ClN7Molecular Weight: 458.042540 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: URTRMMHOVZQXRF-UHFFFAOYSA-N

• NSC 632839 HCL; 3,5-BIS[(4-METHYLPHENYL)METHYLENE]-4-PIPERIDONE HCL
IUPAC Name: (3E,5E)-3,5-bis[(4-methylphenyl)methylidene]piperidin-4-one;hydrochloride | CAS Registry Number: 157654-67-6
Synonyms: NSC632839, NSC-632839, MLS002701647, AC1NS0DO, S4922,NSC632839,157654-67-6, 4-Piperidinone,5-bis[(4-methylphenyl)methylene]-, hydrochloride, (3E,5E)-3,5-bis[(4-methylphenyl)methylidene]piperidin-4-one hydrochloride, 3,5-BIS[(4-METHYLPHENYL)METHYLENE]-4-PIPERIDONE HYDROCHLORIDE

Molecular Formula: C21H22ClNOMolecular Weight: 339.858480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZOKZLTXPTLIWOJ-BYCVLTJGSA-N

• NSC 663284; 6-CHLORO-7-[[2-(4-MORPHOLINYL)ETHYL]AMINO]-5,8-QUINOLINE DIONE
IUPAC Name: 6-chloro-7-(2-morpholin-4-ylethylamino)quinoline-5,8-dione | CAS Registry Number: 383907-43-5
Synonyms: NSC 663284, NSC-663284, 6-Chloro-7-(2-morpholin-4-yl-ethylamino)quinoline-5,8-dione, DA3003-1, 6-chloro-7-{[2-(morpholin-4-yl)ethyl]amino}quinoline-5,8-dione, CDC25 Phosphatase Inhibitor II, NSC 663284, NSC663284, AC1Q3HBE, AC1Q3HBF, SureCN2556224, N7537_SIGMA, AC1L8E02, CHEMBL337173, CTK4H9880, CHEBI:315534, MolPort-003-983-788, HMS3268K22, AR-1H1367, DNC006028, AG-L-03639

Molecular Formula: C15H16ClN3O3Molecular Weight: 321.758840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: BMKPVDQDJQWBPD-UHFFFAOYSA-N

• NSC 66811
IUPAC Name: 7-[anilino(phenyl)methyl]-2-methylquinolin-8-ol | CAS Registry Number: 6964-62-1
Synonyms: NSC-66811, 7-(anilino(phenyl)methyl)-2-methyl-8-quinolinol, 7-(Anilino(phenyl)-methyl)-2-methyl-8-quinolinol, 2-methyl-7-[phenyl(phenylamino)methyl]quinolin-8-ol, NSC66811, AC1L6NIN, AC1Q79MP, SureCN1241576, CHEMBL210778, CTK5D0724, AR-1H2750, DNC006772, AKOS003020553, AG-K-29451, VU0452053-1, 7-[anilino(phenyl)methyl]-2-methylquinolin-8-ol, 2-methyl-7-(phenyl-phenylamino)methyl) quinolin-8-ol, 8-Quinolinol,2-methyl-7-[phenyl(phenylamino)methyl]-, S4923,NSC66811,6964-62-1, 2-METHYL-7-[PHENYL(PHENYLAMINO)METHYL]-8-QUINOLINOL

Molecular Formula: C23H20N2OMolecular Weight: 340.417700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WEENRMPCSWFMTE-UHFFFAOYSA-N

• NSC-33994
IUPAC Name: 2-(diethylaminomethyl)-4-[(E)-4-[3-(diethylaminomethyl)-4-hydroxyphenyl]hex-3-en-3-yl]phenol | CAS Registry Number: 82058-16-0
Synonyms: AC1NV8WC, SureCN2482865, CHEMBL559626, CHEBI:659587, NSC 33994, FT-0673164, (E)-4,4'-(1,2-Diethyl-1,2-ethenediyl)bis[2-[(diethylamino)methyl]phenol, 4,4 inverted exclamation marka-(3E)-Hex-3-ene-3,4-diylbis{2-[(diethylamino)methyl]phenol}, 4,4'-[(1E)-1,2-Diethyl-1,2-ethenediyl]bis[2-[(diethylamino)methyl]phenol, (E)-4,4 inverted exclamation marka-(1,2-Diethyl-1,2-ethenediyl)bis[2-[(diethylamino)methyl]-phenol (9CI), 2-(diethylaminomethyl)-4-[(E)-4-[3-(diethylaminomethyl)-4-hydroxyphenyl]hex-3-en-3-yl]phenol, G6

Molecular Formula: C28H42N2O2Molecular Weight: 438.645280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QFNJFVBKASKGEU-OCEACIFDSA-N

• NSC697923 10MG
IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-nitrofuran | CAS Registry Number: 343351-67-7
Synonyms: NSC697923, MLS002702444, AGN-PC-0JQ5CK, NCIMech_000297, AC1L98AM, Oprea1_719610, CHEMBL1698008, SCHEMBL15200927, SCHEMBL15213579, CTK8D1343, 2-Nitro-5-p-toluenesulfonylfuran, MolPort-003-804-713, 2-nitro-5-(p-tolylsulfonyl)furan, CCG-35232, IN2112, AKOS024458379, NSC-697923, 2-(4-methylphenyl)sulfonyl-5-nitrofuran, NCI60_034979, SMR001566006

Molecular Formula: C11H9NO5SMolecular Weight: 267.257860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: GAUHIPWCDXOLCZ-UHFFFAOYSA-N

• Obatoclax Mesylate
IUPAC Name: 2-[(5Z)-5-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-4-methoxypyrrol-2-ylidene]indole;methanesulfonic acid | CAS Registry Number: 803712-79-0
Synonyms: Obatoclax mesylate, ACT06786

Molecular Formula: C21H23N3O4SMolecular Weight: 413.490020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: ZVAGBRFUYHSUHA-RKMKAUCSSA-N

• OKADAIC ACID; 9,10-DEEPITHIO-9,10-DIDEHYDROACANTHIFOLICIN
IUPAC Name: 2-hydroxy-3-[7-hydroxy-4-[4-[4-hydroxy-2-[1-hydroxy-3-(9-methyl-5,11-dioxaspiro[5.5]undecan-10-yl)butyl]-3-methylidenespiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-2-methyl-5,11-dioxaspiro[5.5]undec-1-en-10-yl]-2-methylpropanoic acid | CAS Registry Number: 78111-17-8
Synonyms: okadaic acid, CID4584

Molecular Formula: C44H68O13Molecular Weight: 805.002920 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 13

InChIKey: QNDVLZJODHBUFM-UHFFFAOYSA-N

• Olaparib
IUPAC Name: 4-[[3-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-4-fluorophenyl]methyl]-2H-phthalazin-1-one | CAS Registry Number: 763113-22-0
Synonyms: AZD 2281, AZD-2281, AZD2281, KU-0059436, S1060_Selleck, Acylpiperazine analogue, 47, 1-(Cyclopropylcarbonyl)-4-[5-[(3,4-dihydro-4-oxo-1-phthalazinyl)methyl]-2-fluorobenzoyl]piperazine, CHEMBL521686, AKOS005145764, 937799-91-2, AZD2281(olaparib), EN002690, KU-59436, KU0059436, FT-0083489, 4-(3-(4-(Cyclopropanecarbonyl)piperazine-1-carbonyl)-4-fluorobenzyl)phthalazin-1(2H)-one, Olaparib, KU-0059436, AZD2281, KU0059436, AZD2281, 4-[3-(4-Cyclopropanecarbonyl-piperazine-1-carbonyl)-4-fluoro-benzyl]-2H-phthalazin-1-one, 4-[(3-{[4-Cyclopropylcarbonyl)piperazin-4-yl]carbonyl}-4-fluorophenyl)methyl]phtalazin-1(2H)-one, OLAPARIB cpd

Molecular Formula: C24H23FN4O3Molecular Weight: 434.462823 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: FDLYAMZZIXQODN-UHFFFAOYSA-N

• Oligomycin A/B/C
IUPAC Name: (1S,4E,5'R,6R,6'R,7S,8R,10S,11S,12R,14S,15R,16S,18E,20E,22S,25R,27S,28R,29S)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethylspiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-oxane]-3,9,13-trione | CAS Registry Number: 1404-19-9
Synonyms: oligomycin A, Oligomycin, OLIGOMYCIN (A shown), BSPBio_000988, BSPBio_003314, SPECTRUM1601001, BCBcMAP01_000052, EINECS 209-437-3, BRN 5702132, RP-32705, CID5281899, IDI1_000029, IDI1_002089, NCGC00163472-01, LS-98327, C11311, 579-13-5, (1S,4E,5'R,6R,6'R,7S,8R,10S,11S,12R,14S,15R,16S,18E,20E,22S,25R,27S,28R,29S)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethyl-3',4',5',6'-tetrahydro-3H,9H,13H-spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-pyran]-3,9,13-trione

Molecular Formula: C45H74O11Molecular Weight: 791.062460 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 11

InChIKey: MNULEGDCPYONBU-WMBHJXFZSA-N

• OLTIPRAZ
IUPAC Name: 4-methyl-5-pyrazin-2-yldithiole-3-thione | CAS Registry Number: 64224-21-1
Synonyms: Oltipraz, Oltiprazum, Oltipraz [INN], 4-methyl-PDT, Oltiprazum [INN-Latin], CCRIS 4048, UNII-6N510JUL1Y, C8H6N2S3, EINECS 264-736-6, CHEBI:400769, NSC347901, AIDS042741, HMS2090F09, RP 35972, NSC 347901, AIDS-042741, CID47318, BRN 0978110, RP-35,972, LS-7628

Molecular Formula: C8H6N2S3Molecular Weight: 226.341640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CKNAQFVBEHDJQV-UHFFFAOYSA-N

• Optovin
IUPAC Name: (5E)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | CAS Registry Number: 348575-88-2
Synonyms: AC1LRA0Z, Ambcb6197309, SCHEMBL14305788, MolPort-002-188-638, CCG-14653, ZINC13546840, AKOS000337708, BIM-0018214.P001, AB00104090-01, S8073,348575-88-2, (5E)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Molecular Formula: C15H13N3OS2Molecular Weight: 315.413220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YISGMOZSGOGYOU-NTUHNPAUSA-N

• Orlistat
IUPAC Name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2S)-2-formamido-4-methylpentanoate | CAS Registry Number: 96829-58-2
Synonyms: orlistat, Orlipastat, Xenical, Tetrahydrolipstatin, Alli, (-)-Tetrahydrolipstatin, Xenical (TN), THLP, Orlipastatum [INN-Latin], Orlistat [USAN:INN], Ambap2777, nchembio.129-comp24, Orlistat (USAN/INN), MLS000759448, MLS001423955, O4139_SIGMA, C29H53NO5, (−)-Tetrahydrolipstatin, Ro-18-0647, CID3034010

Molecular Formula: C29H53NO5Molecular Weight: 495.734820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: AHLBNYSZXLDEJQ-FWEHEUNISA-N

• OUABAIN OCTAHYDRATE,HPLC
IUPAC Name: 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;octahydrate | CAS Registry Number: 11018-89-6
Synonyms: Strophantine octahydrate, Ouabain octahydrate, Quabain octahydrate, Prestwick_370, Ouabain [USP], AC1O4BRT, SureCN413472, CHEMBL1889436, UNII-1K0J875G48, HMS1569O04, HMS2096O04, Card-20(22)-enolide, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-1,5,11,14,19-pentahydroxy-, octahydrate, (1beta,3beta,5beta,11alpha)-, NCGC00017394-06, NCGC00094248-05, SR-01000076047, SR-01000076047-6, S4016,11018-89-6, 1|A,3|A,5|A,11|A,14,19-Hexahydroxycard-20(22)-enolide 3-(6-deoxy-|A-L-mannopyranoside), 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one octahydrate

Molecular Formula: C29H60O20Molecular Weight: 728.774700 [g/mol]
H-Bond Donor: 16H-Bond Acceptor: 20

InChIKey: TYBARJRCFHUHSN-DMJRSANLSA-N

• Oxaprozin
IUPAC Name: 3-[4,5-di(phenyl)-1,3-oxazol-2-yl]propanoic acid | CAS Registry Number: 21256-18-8
Synonyms: oxaprozin, Daypro, Alvo, Deflam, Voir, Duraprox, Actirin, Xopane, Daypro (TN), Oxaprozine [INN-French], Oxaprozinum [INN-Latin], Oxaprozina [INN-Spanish], Maybridge1_008800, Prestwick0_001060, Prestwick1_001060, Prestwick2_001060, Prestwick3_001060, Spectrum2_001696, Spectrum3_001078, Spectrum4_001231

Molecular Formula: C18H15NO3Molecular Weight: 293.316600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OFPXSFXSNFPTHF-UHFFFAOYSA-N

• Ozagrel hydrochloride
IUPAC Name: (E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid hydrochloride | CAS Registry Number: 78712-43-3
Synonyms: ozagrel hydrochloride, OZAGREL HCl, OKY 046 hydrochloride, OKY-046 hydrochloride, OKY-046, Ozagrel hydrochloride hydrate, MLS001401435, O1385_SIGMA, C13H12N2O2.HCl.H2O, CID6438130, ozagrel, monohydrochloride, (E)-isomer, CPD000469164, SAM001246593, SMR000469164, LS-123661, TL8005361, C13144, (E)-3-(4-(1H-Imidazol-1-ylmethyl)phenyl)-2-propenoic acid hydrochloride, 2-Propenoic acid, 3-(4-(1H-imidazol-1-ylmethyl)phenyl)-, monohydrochloride, (E)-, (E)-3-[4-(Imidazol-1-ylmethyl)phenyl]propenoic acid hydrochloride hydrate

Molecular Formula: C13H13ClN2O2Molecular Weight: 264.707520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: CWKFWBJJNNPGAM-IPZCTEOASA-N

• P005091
IUPAC Name: 1-[5-(2,3-dichlorophenyl)sulfanyl-4-nitrothiophen-2-yl]ethanone | CAS Registry Number: 882257-11-6
Synonyms: CHEMBL2159495, ZINC00125366, SureCN2681288, AC1ME173, MolPort-002-906-122, KM03205, QC-8200, 1-(5-(2,3-dichlorophenylthio)-4-nitrothiophen-2-yl)ethanone, 1-[5-(2,3-dichlorophenyl)sulfanyl-4-nitrothiophen-2-yl]ethanone, 1-{5-[(2,3-dichlorophenyl)thio]-4-nitro-2-thienyl}ethan-1-one

Molecular Formula: C12H7Cl2NO3S2Molecular Weight: 348.224880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: LKZLGMAAKNEGCH-UHFFFAOYSA-N

• Paclitaxel
Synonyms: paclitaxel, Yewtaxan, TAXOL, Plaxicel, Paxceed, Taxol A, Abraxane, Ebetaxel, Capxol, Paxene, Onxol, TaxAlbin, LipoPac, Genetaxyl, Nanotaxel, Paclical, Pacligel, Anzatax, Genaxol, Genexol

Molecular Formula: C47H51NO14Molecular Weight: 853.906140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 14

InChIKey: RCINICONZNJXQF-MZXODVADSA-N

• PALMITOYLETHANOLAMIDE; N-(2-HYDROXYETHYL)HEXADECANAMIDE
IUPAC Name: N-(2-hydroxyethyl)hexadecanamide | CAS Registry Number: 544-31-0
Synonyms: Palmidrol, Palmitoylethanolamide, Impulsin, Palmitamide MEA, Palmidrolum, Palmdrol prodes, N-palmitoylethanolamine, palmitylethanolamide, MimyX, Loramine P 256, Hydroxyethylpalmitamide, Palmidrol (INN), Palmidrol [INN], nchembio.86-comp10, N-(2-Hydroxyethyl)palmitamide, Palmdrol prodes (TN), Palmidrolum [INN-Latin], N-(2-Hydroxyethyl)hexadecanamide, Tocris-0879, Palmitic acid monoethanolamide

Molecular Formula: C18H37NO2Molecular Weight: 299.491880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HXYVTAGFYLMHSO-UHFFFAOYSA-N

• Panobinostat
IUPAC Name: (E)-N-hydroxy-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]phenyl]prop-2-enamide | CAS Registry Number: 404950-80-7
Synonyms: Faridak, LBH-589, NVP-LBH-589, LBH-589B, LBH589, LBH 589, ZINC22010649, CID6918837, 2-Propenamide, N-hydroxy-3-(4-(((2-(2-methyl-1H-indol-3-yl)ethyl)amino)methyl)phenyl)-, (2E)-

Molecular Formula: C21H23N3O2Molecular Weight: 349.426220 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 3

InChIKey: FPOHNWQLNRZRFC-ZHACJKMWSA-N

• Parthenolide
Synonyms: parthenolide, (-)-Parthenolide, Bio-0620, MEGxp0_000050, ACon1_001961, CHEBI:443035, AIDS007764, AIDS-007764, NSC157035, CID6473881, NSC-157035, (1aR,7aS,10aS,10bS)-1a,5-dimethyl-8-methylidene-2,3,6,7,7a,8,10a,10b-octahydrooxireno[9,10]cyclodeca[1,2-b]furan-9(1aH)-one, (1aR,7aS,10aS,10bS,Z)-1a,5-dimethyl-8-methylene-2,3,6,7,7a,8-hexahydro-11-oxa-bicyclo[8.1.0]undeca-1(10),4-dieno[9,8-b]furan-9(1aH,10aH,10bH)-one, Germacra-1(10),11(13)-dien-12-oic acid, 4,5.alpha.-epoxy-6.beta.-hydroxy-, gamma.-lactone, Oxireno[9,10]cyclodeca[1,2-b]furan-9(1aH)-one, 2,3,6,7,7a,8,10a,10b-octahydro-1a,5-dimethyl-8-methylene-, (1aR,4E,7aS,10aS,10bS)-, PTL

Molecular Formula: C15H20O3Molecular Weight: 248.317500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KTEXNACQROZXEV-SLXBATTESA-N

• PD 0325901
IUPAC Name: N-[(2R)-2,3-dihydroxypropoxy]-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide | CAS Registry Number: 391210-10-9
Synonyms: nchembio.282-comp3, CHEBI:553228, ZINC03938683, CID9826528, PD-0325901, PD325901, PD 325901, PD-325901, PD0325901, C506614, (R)-(-)-N-(2,3-dihydroxy-propoxy)-3,4-difluoro-2-(2-fluoro-4-iodophenylamino)-benzamide, N-[((R)-2,3-dihydroxypropyl)oxy]-3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]benzamide, N-[(2R)-2,3-dihydroxypropoxy]-3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]benzamide, N-{[(2R)-2,3-dihydroxypropyl]oxy}-3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]benzamide, 4BM, 870474-62-7

Molecular Formula: C16H14F3IN2O4Molecular Weight: 482.193040 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: SUDAHWBOROXANE-SECBINFHSA-N

• PD 173074
IUPAC Name: 1-tert-butyl-3-[2-[4-(diethylamino)butylamino]-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]urea | CAS Registry Number: 219580-11-7
Synonyms: PD173074, PD-173074, CHEBI:63448, 1-tert-butyl-3-[2-{[4-(diethylamino)butyl]amino}-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]urea, FGF/VEGF Receptor Tyrosine Kinase Inhibitor, PD173074, PD173074, 219580-11-7, 2fgi, 1-(tert-Butyl)-3-(2-((4-(diethylamino)butyl)amino)-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl)urea, 1-t-Butyl-3-(6-(3,5-dimethoxyphenyl)-2-(4-diethylaminobutylamino)-pyrido[2,3-d]pyrimidin-7-yl)urea, 1-tert-butyl-3-(2-(4-(diethylamino)butylamino)-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl)urea, 1-tert-butyl-3-[6-(3,5-dimethoxy-phenyl)-2-(4-diethylamino-butylamino)-pyrido[2,3-d]pyrimidin-7-yl]-urea, PD1, 1-tert-butyl-3-[2-[4-(diethylamino)butylamino]-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]urea, S1264_Selleck, PubChem22593, SureCN177946, AC1L1BE8, UNII-A4TLL8634Y, JSPY-st000263, cc-523

Molecular Formula: C28H41N7O3Molecular Weight: 523.670240 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: DXCUKNQANPLTEJ-UHFFFAOYSA-N

• PENITREM A
Synonyms: penitrem A, Tremortin A, Tremortin, NSC 354845, CID337313, NSC354845, LS-101380, 12679-82-2

Molecular Formula: C37H44ClNO6Molecular Weight: 634.201360 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: JDUWHZOLEDOQSR-JHMXYHNCSA-N

• Pepstatin
IUPAC Name: 3-hydroxy-4-[2-[[3-hydroxy-6-methyl-4-[[3-methyl-2-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoylamino]-6-methylheptanoic acid | CAS Registry Number: 26305-03-3
Synonyms: Pepstatin A, pepstatin, Ahpatinin C, Pepstatin (VAN), Pepstatin (nonspecific), Isoval-Val-Val-Sta-Ala-Sta, CCRIS 3603, CID4742, CHEBI:157419, NSC272671, C34H63N5O9, LS-174777, 3-Hydroxy-4-[2-(3-hydroxy-6-methyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoylamino)-propionylamino]-6-methyl-heptanoic acid, Heptanoic acid, N-(3-methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl-4-amino-3-hydroxy-6-methyl-, N-(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl-4-amino-3-hydroxy-6-methylheptanoic acid

Molecular Formula: C34H63N5O9Molecular Weight: 685.892120 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 9

InChIKey: FAXGPCHRFPCXOO-UHFFFAOYSA-N

• PF-622
IUPAC Name: N-phenyl-4-(quinolin-2-ylmethyl)piperazine-1-carboxamide | CAS Registry Number: 898235-65-9
Synonyms: AGN-PC-00AOHZ, SureCN3600412, CHEMBL513789, CTK8F0013, MolPort-009-019-356, DNC013697, ZINC27647183, KB-79895, 1-Piperazinecarboxamide, N-phenyl-4-(2-quinolinylmethyl)-

Molecular Formula: C21H22N4OMolecular Weight: 346.425580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SNTCRRMCALVGNL-UHFFFAOYSA-N

• Phenol, 4-[4-(4-Fluorophenyl)-5-(4-Pyridinyl)-1h-Imidazol-2-Yl]-
IUPAC Name: 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one | CAS Registry Number: 152121-30-7
Synonyms: FHPI, nchembio873-comp13, Tocris-1264, BiomolKI_000051, Lopac-S-7067, SB 202190, BiomolKI2_000057, Lopac0_000173, BSPBio_001106, KBioGR_000446, KBioSS_000446, MLS002153419, SB 202190, Immobilized, S7067_SIGMA, SB-202190, KBio2_000446, KBio2_003014, KBio2_005582, KBio3_000831, KBio3_000832

Molecular Formula: C20H14FN3OMolecular Weight: 331.343063 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NJNKPVPFGLGHPA-UHFFFAOYSA-N

• Phenoxybenzamine Hydrochloride
IUPAC Name: N-(2-chloroethyl)-1-(phenoxy)-N-(phenylmethyl)propan-2-amine hydrochloride | CAS Registry Number: 63-92-3
Synonyms: Dibenzyline, fenoxybenzamin, Dibenzylene, Dibenzyran, Bensylyt, Benzylyt, Blocadren, Dibenylin, Bensylyt NEN, Phenoxybenzamine hydrochloride, Phenoxybenzamine Hcl, Phenoxybenzamine.HCl, Dibenzyline (TN), Dibenzyline chloride, Dibenzyline hydrochloride, POB HCl, Phenoxybenzamine chloride, C18H22ClNO.HCl, Dibenzyline hyd rochloride, B019_SIGMA

Molecular Formula: C18H23Cl2NOMolecular Weight: 340.287320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VBCPVIWPDJVHAN-UHFFFAOYSA-N

• Phorbol Myristate Acetate
Synonyms: Phorbol ester, yristate, Factor A1, -yl ester, Phorbol myristate acetate, PMA (tumor promoter), Factor A1 (croton oil), nchembio.154-comp9, TPA (phorbol derivative), Phorbol 12-myristate 13-acetate, SpecPlus_000801, Tetradecanoylphorbol acetate, Phorbol-myristate acetate, 12-Tetradecanoylphorbol 13-acetate, Spectrum2_001911, Spectrum4_000889, Spectrum5_001855, Phorbol acetate, myristate, CCRIS 716, MolMap_000041

Molecular Formula: C36H56O8Molecular Weight: 616.825040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: PHEDXBVPIONUQT-RGYGYFBISA-N

• Phytosphingosine
IUPAC Name: (2S,3S,4R)-2-aminooctadecane-1,3,4-triol | CAS Registry Number: 554-62-1
Synonyms: phytosphingosine, 4-hydroxysphinganine, 4-D-Hydroxysphinganine, nchembio.191-comp6, D-Ribo-phytosphingosine, Phytosphingosine hydrochloride, P2795_SIGMA, CHEBI:46961, MolPort-003-959-216, CID122121, LMSP01030001, D-Ribo-2-aminooctadecane-1,3,4-triol, SMP2_000142, NCGC00163609-01, D-Ribo-1,3,4-trihydroxy-2-aminooctadecane, P1765, (2S,3S,4R)-2-Amino-1,3,4-octadecanetriol, C12144, 1,3,4-Octadecanetriol, 2-amino-, (2S-(2R*,3R*,4S*))-, PHS

Molecular Formula: C18H39NO3Molecular Weight: 317.507160 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: AERBNCYCJBRYDG-KSZLIROESA-N


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