Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BQ6J8Y
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| Binder Name |
N-[5-[[5-[(3-Amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-4-formamido-1-methylpyrrole-2-carboxamide;methyl 3-[[(6aS)-2-methoxy-11-oxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propanoate
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| Synonyms |
CHEMBL101290
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL
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| Formula |
C39H47N11O9
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| Canonical SMILES |
CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC=O.COC1=C(C=C2C(=C1)C(=O)N3CCC[C@H]3C=N2)OCCC(=O)OC
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| InChI |
1S/C22H27N9O4.C17H20N2O5/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24;1-22-14-8-12-13(9-15(14)24-7-5-16(20)23-2)18-10-11-4-3-6-19(11)17(12)21/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34);8-11H,3-7H2,1-2H3/t;11-/m.0/s1
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| InChIKey |
ODDCESZVGLRPTM-WUSPCOQVSA-N
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| PubChem Compound ID | ||||
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