General Information of the Compound
| Compound ID |
CP0914693
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| Compound Name |
N-(3-(1-(4-(4,6-difluoro-1-(4-fluorophenyl)-1H-benzo[d]imidazole-2-carbonyl)benzyl)piperidin-4-yl)phenyl)acetamide
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| Structure |
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| Formula |
C34H29F3N4O2
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| Molecular Weight |
582.626
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| Canonical SMILES |
CC(=O)Nc1cccc(C2CCN(Cc3ccc(C(=O)c4nc5c(F)cc(F)cc5n4-c4ccc(F)cc4)cc3)CC2)c1
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| InChI |
InChI=1S/C34H29F3N4O2/c1-21(42)38-28-4-2-3-25(17-28)23-13-15-40(16-14-23)20-22-5-7-24(8-6-22)33(43)34-39-32-30(37)18-27(36)19-31(32)41(34)29-11-9-26(35)10-12-29/h2-12,17-19,23H,13-16,20H2,1H3,(H,38,42)
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| InChIKey |
NAGSCCRSHRFUSD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound