Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LIG59A
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| Ligand Name |
2-{6-({[2-(1H-indol-3-yl)ethyl]carbamothioyl}amino)-3-[(4-methylpiperazin-1-yl)methyl]-1H-indol-1-yl}-N-(propan-2-yl)acetamide
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| Synonyms |
CHEMBL4172762; 2-{6-({[2-(1H-indol-3-yl)ethyl]carbamothioyl}amino)-3-[(4-methylpiperazin-1-yl)methyl]-1H-indol-1-yl}-N-(propan-2-yl)acetamide; BDBM50366282; F8J
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| Structure |
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Download2D MOL |
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| Formula |
C30H39N7OS
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| Canonical SMILES |
CC(C)NC(=O)CN1C=C(C2=C1C=C(C=C2)NC(=S)NCCC3=CNC4=CC=CC=C43)CN5CCN(CC5)C
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| InChI |
1S/C30H39N7OS/c1-21(2)33-29(38)20-37-19-23(18-36-14-12-35(3)13-15-36)26-9-8-24(16-28(26)37)34-30(39)31-11-10-22-17-32-27-7-5-4-6-25(22)27/h4-9,16-17,19,21,32H,10-15,18,20H2,1-3H3,(H,33,38)(H2,31,34,39)
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| InChIKey |
DCSGGGDRUYCRAM-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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