Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8E2KM
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| Ligand Name |
2-[[5-[2-(3,5-dimethoxyphenyl)ethyl]-2-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]pyrimidin-4-yl]amino]-N-ethyl-benzenesulfonamide
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| Synonyms |
CHEMBL4634918; 2-[[5-[2-(3,5-dimethoxyphenyl)ethyl]-2-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]pyrimidin-4-yl]amino]-N-ethyl-benzenesulfonamide; BDBM50545471
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| Structure |
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Download2D MOL
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| Formula |
C39H52N8O5S
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| Canonical SMILES |
CCNS(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2CCC3=CC(=CC(=C3)OC)OC)NC4=CC(=C(C=C4)N5CCC(CC5)N6CCN(CC6)C)OC
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| InChI |
1S/C39H52N8O5S/c1-6-41-53(48,49)37-10-8-7-9-34(37)43-38-29(12-11-28-23-32(50-3)26-33(24-28)51-4)27-40-39(44-38)42-30-13-14-35(36(25-30)52-5)47-17-15-31(16-18-47)46-21-19-45(2)20-22-46/h7-10,13-14,23-27,31,41H,6,11-12,15-22H2,1-5H3,(H2,40,42,43,44)
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| InChIKey |
WIMNUEGOKSDWHG-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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