Binder Information
Binder General Information | Top | |||
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Binder ID |
B1FOG8
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Binder Name |
CID 57522349
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Synonyms |
CHEMBL2058238; SCHEMBL15062586; BDBM50388284
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL |
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Formula |
C31H33F2NO9S
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Canonical SMILES |
COC1=C(C=C(C=C1)CC[C@H](C2=CC(=CC=C2)OCC(=O)O)OC(=O)[C@@H]3CCCCN3S(=O)(=O)C4=CC(=CC(=C4)F)F)OC
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InChI |
1S/C31H33F2NO9S/c1-40-28-12-10-20(14-29(28)41-2)9-11-27(21-6-5-7-24(15-21)42-19-30(35)36)43-31(37)26-8-3-4-13-34(26)44(38,39)25-17-22(32)16-23(33)18-25/h5-7,10,12,14-18,26-27H,3-4,8-9,11,13,19H2,1-2H3,(H,35,36)/t26-,27+/m0/s1
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InChIKey |
KBBJHTXSCSXDMI-RRPNLBNLSA-N
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PubChem Compound ID |
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