Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8WI1R
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| Ligand Name |
4-{8-Chloro-11-[3-(4-Chloro-3,5-Dimethylphenoxy)propyl]-1-Oxo-7-(1,3,5-Trimethyl-1h-Pyrazol-4-Yl)-4,5-Dihydro-1h-[1,4]diazepino[1,2-A]indol-2(3h)-Yl}-1-Methyl-1h-Indole-6-Carboxylic Acid
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| Synonyms |
CHEMBL4086356; 4-{8-Chloro-11-[3-(4-Chloro-3,5-Dimethylphenoxy)propyl]-1-Oxo-7-(1,3,5-Trimethyl-1h-Pyrazol-4-Yl)-4,5-Dihydro-1h-[1,4]diazepino[1,2-A]indol-2(3h)-Yl}-1-Methyl-1h-Indole-6-Carboxylic Acid; 6AK; SCHEMBL17127769; BDBM50244142; J3.639.829I; 1-Methyl-4-[1-oxo-7-(1,3,5-trimethyl-1H-pyrazole-4-yl)-8-chloro-11-[3-(3,5-dimethyl-4-chlorophenoxy)propyl]-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,2-a]indole-2-yl]-1H-indole-6-carboxylic acid
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| Structure |
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Download2D MOL |
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| Formula |
C39H39Cl2N5O4
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| Canonical SMILES |
CC1=CC(=CC(=C1Cl)C)OCCCC2=C3C(=O)N(CCCN3C4=C2C=CC(=C4C5=C(N(N=C5C)C)C)Cl)C6=CC(=CC7=C6C=CN7C)C(=O)O
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| InChI |
1S/C39H39Cl2N5O4/c1-21-17-26(18-22(2)35(21)41)50-16-7-9-27-28-10-11-30(40)34(33-23(3)42-44(6)24(33)4)36(28)46-14-8-13-45(38(47)37(27)46)32-20-25(39(48)49)19-31-29(32)12-15-43(31)5/h10-12,15,17-20H,7-9,13-14,16H2,1-6H3,(H,48,49)
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| InChIKey |
BDINUPBROUJUMH-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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