Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L2MRA5
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| Ligand Name |
2-(3-{4-Chloro-3-[(4-chloro-3-{[(phenylmethyl)amino]methyl}phenyl)ethynyl]phenyl}-1-{3-[(3S)-3-methylmorpholin-4-yl]propyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-2-oxoacetamide
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| Synonyms |
2-(3-[3-({3-[(benzylamino)methyl]-4-chlorophenyl}ethynyl)-4-chlorophenyl]-1-{3-[(3S)-3-methylmorpholin-4-yl]propyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-2-oxoacetamide; SCHEMBL4573659; BDBM586505; 2-(3-{4-Chloro-3-[(4-chloro-3-{[(phenylmethyl)amino]methyl}phenyl)ethynyl]phenyl}-1-{3-[(3S)-3-methylmorpholin-4-yl]propyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-2-oxoacetamide; BJS
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| Structure |
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Download2D MOL |
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| Formula |
C38H40Cl2N6O3
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| Canonical SMILES |
CC1COCCN1CCCN2C3=C(CN(CC3)C(=O)C(=O)N)C(=N2)C4=CC(=C(C=C4)Cl)C#CC5=CC(=C(C=C5)Cl)CNCC6=CC=CC=C6
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| InChI |
1S/C38H40Cl2N6O3/c1-26-25-49-19-18-44(26)15-5-16-46-35-14-17-45(38(48)37(41)47)24-32(35)36(43-46)30-11-13-33(39)29(21-30)10-8-27-9-12-34(40)31(20-27)23-42-22-28-6-3-2-4-7-28/h2-4,6-7,9,11-13,20-21,26,42H,5,14-19,22-25H2,1H3,(H2,41,47)/t26-/m0/s1
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| InChIKey |
CIONECARUUEYBQ-SANMLTNESA-N
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| PubChem Compound ID | ||||
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