Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3PL8S
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| Ligand Name |
4-[4-({4'-Chloro-3-[2-(Dimethylamino)ethoxy]biphenyl-2-Yl}methyl)piperazin-1-Yl]-2-(1h-Indol-5-Yloxy)-N-({3-Nitro-4-[(Tetrahydro-2h-Pyran-4-Ylmethyl)amino]phenyl}sulfonyl)benzamide
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| Synonyms |
4-[4-({4'-Chloro-3-[2-(Dimethylamino)ethoxy]biphenyl-2-Yl}methyl)piperazin-1-Yl]-2-(1h-Indol-5-Yloxy)-N-({3-Nitro-4-[(Tetrahydro-2h-Pyran-4-Ylmethyl)amino]phenyl}sulfonyl)benzamide; 1Y1; SCHEMBL1955522; CHEMBL3794549; BDBM178570; US9125913, 129; Q27452562
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| Structure |
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Download2D MOL
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| Formula |
C48H52ClN7O8S
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| Canonical SMILES |
CN(C)CCOC1=CC=CC(=C1CN2CCN(CC2)C3=CC(=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NCC5CCOCC5)[N+](=O)[O-])OC6=CC7=C(C=C6)NC=C7)C8=CC=C(C=C8)Cl
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| InChI |
1S/C48H52ClN7O8S/c1-53(2)24-27-63-46-5-3-4-40(34-6-8-36(49)9-7-34)42(46)32-54-20-22-55(23-21-54)37-10-13-41(47(29-37)64-38-11-14-43-35(28-38)16-19-50-43)48(57)52-65(60,61)39-12-15-44(45(30-39)56(58)59)51-31-33-17-25-62-26-18-33/h3-16,19,28-30,33,50-51H,17-18,20-27,31-32H2,1-2H3,(H,52,57)
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| InChIKey |
OEPSXIVYHBPSCA-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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