Approved Ligands
Shop By
-
Acetylsalicylic acid, Channel blocker of ASIC3;Inhibitor of COX-1;Inhibitor of COX-2Cas#: 50-78-2 Compound CID: 2244Formula: C9H8O4 Molecular Weight: 180.16IUPAC Name: 2-acetyloxybenzoic acidSMILES: CC(=O)OC1=CC=CC=C1C(=O)OInChIKey: BSYNRYMUTXBXSQ-UHFFFAOYSA-NInChI: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)Synonyms: ASA | Acesal | Acetisal | Aspirdrops | Solpyron | A.S.A. empirin | Acetosal | Benaspir | Contrheuma retard | Acido ac...
-
Carprofen, Cyclooxygenase-2 inhibitorCas#: 53716-49-7 Compound CID: 2581Formula: C15H12ClNO2 Molecular Weight: 273.72IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acidSMILES: CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)OInChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-NInChI: InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)Synonyms: (S)-alpha-Methyl-6-chloro-9H-carbazole-2-acetic acid | 9H-Carbazole-2-acetic acid, 6-chloro-.alpha.-methyl- | Rimadyl...
-
Ketorolac, Inhibitor of COX-1;Inhibitor of COX-2Cas#: 74103-06-3 Compound CID: 3826Formula: C15H13NO3 Molecular Weight: 255.27IUPAC Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acidSMILES: C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OInChIKey: OZWKMVRBQXNZKK-UHFFFAOYSA-NInChI: InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)Synonyms: KETOROLAC [INN] | KETOROLAC [MI] | FT-0653523 | ketorolac | Ketorolaco | 1H-Pyrrolizine-1-carboxylic acid, 2,3-dihydr...
-
Lumiracoxib, Cyclooxygenase-2 inhibitorCas#: 220991-20-8 Compound CID: 151166Formula: C15H13ClFNO2 Molecular Weight: 293.72IUPAC Name: 2-[2-(2-chloro-6-fluoroanilino)-5-methylphenyl]acetic acidSMILES: CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)CC(=O)OInChIKey: KHPKQFYUPIUARC-UHFFFAOYSA-NInChI: InChI=1S/C15H13ClFNO2/c1-9-5-6-13(10(7-9)8-14(19)20)18-15-11(16)3-2-4-12(15)17/h2-7,18H,8H2,1H3,(H,19,20)Synonyms: {2-[(2-chloro-6-fluorophenyl)amino]-5-methylphenyl}acetic acid | BL164650 | 2-(2-(2-chloro-6-fluorophenylamino)-5-met...
-
Etodolac, Cyclooxygenase-2 inhibitorCas#: 41340-25-4 Compound CID: 3308Formula: C17H21NO3 Molecular Weight: 287.35IUPAC Name: 2-(1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acidSMILES: CCC1=C2C(=CC=C1)C3=C(N2)C(OCC3)(CC)CC(=O)OInChIKey: NNYBQONXHNTVIJ-UHFFFAOYSA-NInChI: InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)Synonyms: Etodolac,(S) | Osteluc | Spectrum4_000410 | Etodolac (USAN:USP:INN:BAN) | Etodolac [USAN:USP:INN:BAN] | AY 24236 | Et...
-
Diclofenac, Cyclooxygenase inhibitorCas#: 15307-86-5 Compound CID: 3033Formula: C14H11Cl2NO2 Molecular Weight: 296.15IUPAC Name: 2-[2-(2,6-dichloroanilino)phenyl]acetic acidSMILES: C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)ClInChIKey: DCOPUUMXTXDBNB-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)Synonyms: CHEBI:47381 | DICLOFENAC (MART.) | DTXSID6022923 | 15307-86-5 (free) | UNII-144O8QL0L1 | ACETIC ACID, (o-(2,6-DICHLOR...
-
Etoricoxib, Cyclooxygenase-2 inhibitorCas#: 202409-33-4 Compound CID: 123619Formula: C18H15ClN2O2S Molecular Weight: 358.84IUPAC Name: 5-chloro-2-(6-methylpyridin-3-yl)-3-(4-methylsulfonylphenyl)pyridineSMILES: CC1=NC=C(C=C1)C2=C(C=C(C=N2)Cl)C3=CC=C(C=C3)S(=O)(=O)CInChIKey: MNJVRJDLRVPLFE-UHFFFAOYSA-NInChI: InChI=1S/C18H15ClN2O2S/c1-12-3-4-14(10-20-12)18-17(9-15(19)11-21-18)13-5-7-16(8-6-13)24(2,22)23/h3-11H,1-2H3Synonyms: MK-663 | MK-0663 | Etoricoxibe | F2173-0490 | SR-05000001486 | HY-15321 | Kingcox | 5-chloro-2-(6-methylpyridin-3-yl)...
-
Sunitinib, Inhibitor of fibroblast growth factor receptor 1;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of fms related receptor tyrosine kinase 4;Inhibitor of kinase insert domain receptor;Inhibitor of KIT proto-oncogene; receptor tyrosine kinase;ICas#: 557795-19-4 Compound CID: 5329102Formula: C22H27FN4O2 Molecular Weight: 398.47IUPAC Name: N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamideSMILES: CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=C2C3=C(C=CC(=C3)F)NC2=O)CInChIKey: WINHZLLDWRZWRT-ATVHPVEESA-NInChI: InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-Synonyms: 1H-Pyrrole-3-carboxamide,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl- | D08552 | C22H27FN4O2 | N-(2-(Diet...
-
alpha-methyl-L-tyrosine, Tyrosine 3-hydroxylase inhibitorCas#: 672-87-7 Compound CID: 441350Formula: C10H13NO3 Molecular Weight: 195.22IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acidSMILES: CC(CC1=CC=C(C=C1)O)(C(=O)O)NInChIKey: NHTGHBARYWONDQ-JTQLQIEISA-NInChI: InChI=1S/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m0/s1Synonyms: DTXCID203315 | Metirosina [INN-Spanish] | Metirosinum | Metyrosine [USAN] | MFCD00064201 | NCGC00094144-03 | s8033 | ...
-
α-Methyl-L-tyrosineCas#: 672-87-7 Compound CID: 441350Formula: C10H13NO3 Molecular Weight: 195.22IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acidSMILES: CC(CC1=CC=C(C=C1)O)(C(=O)O)NInChIKey: NHTGHBARYWONDQ-JTQLQIEISA-NInChI: InChI=1S/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m0/s1Synonyms: DTXCID203315 | Metirosina [INN-Spanish] | Metirosinum | Metyrosine [USAN] | MFCD00064201 | NCGC00094144-03 | s8033 | ...
-
CH5424802, Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinaseCas#: 1256580-46-7 Compound CID: 49806720Formula: C30H34N4O2 Molecular Weight: 482.62IUPAC Name: 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrileSMILES: CCC1=CC2=C(C=C1N3CCC(CC3)N4CCOCC4)C(C5=C(C2=O)C6=C(N5)C=C(C=C6)C#N)(C)CInChIKey: KDGFLJKFZUIJMX-UHFFFAOYSA-NInChI: InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3Synonyms: Alectinib|1256580-46-7|CH5424802|AF-802|CH 5424802|AF802|RO5424802|UNII-LIJ4CT1Z3Y|Alectinib (CH5424802)|LIJ4CT1Z3Y|C...
-
CH5424802, Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinaseCas#: 1256580-46-7 Compound CID: 49806720Formula: C30H34N4O2 Molecular Weight: 482.62IUPAC Name: 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrileSMILES: CCC1=CC2=C(C=C1N3CCC(CC3)N4CCOCC4)C(C5=C(C2=O)C6=C(N5)C=C(C=C6)C#N)(C)CInChIKey: KDGFLJKFZUIJMX-UHFFFAOYSA-NInChI: InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3Synonyms: AF 802 | SR-01000389722-2 | 9-ETHYL-6,6-DIMETHYL-8-[4-(MORPHOLIN-4-YL)PIPERIDIN-1-YL]-11-OXO-5H,6H,11H-BENZO[B]CARBAZ...
