Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BB9N5G
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| Binder Name |
N-[(1S)-5-Amino-1-cyanopentyl]-3-[3-[1-[(4-fluorophenyl)methyl]indol-3-yl]propanoylamino]-4-(pyridin-4-ylmethoxy)benzamide
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| Synonyms |
CHEMBL1910642; BDBM50355960
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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 |
C37H37FN6O3
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| Canonical SMILES |
C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)F)CCC(=O)NC4=C(C=CC(=C4)C(=O)N[C@@H](CCCCN)C#N)OCC5=CC=NC=C5
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| InChI |
1S/C37H37FN6O3/c38-30-12-8-26(9-13-30)23-44-24-29(32-6-1-2-7-34(32)44)11-15-36(45)43-33-21-28(37(46)42-31(22-40)5-3-4-18-39)10-14-35(33)47-25-27-16-19-41-20-17-27/h1-2,6-10,12-14,16-17,19-21,24,31H,3-5,11,15,18,23,25,39H2,(H,42,46)(H,43,45)/t31-/m0/s1
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| InChIKey |
QKEXCTCUWLBMGS-HKBQPEDESA-N
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| PubChem Compound ID | ||||
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