General Information of the Compound
| Compound ID |
CP0857738
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| Compound Name |
N-(3-(1-(4-(1-isopropyl-1H-benzo[d]imidazole-2-carbonyl)benzyl)piperidin-4-yl)phenyl)acetamide
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| Structure |
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| Formula |
C31H34N4O2
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| Molecular Weight |
494.639
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| Canonical SMILES |
CC(=O)Nc1cccc(C2CCN(Cc3ccc(C(=O)c4nc5ccccc5n4C(C)C)cc3)CC2)c1
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| InChI |
InChI=1S/C31H34N4O2/c1-21(2)35-29-10-5-4-9-28(29)33-31(35)30(37)25-13-11-23(12-14-25)20-34-17-15-24(16-18-34)26-7-6-8-27(19-26)32-22(3)36/h4-14,19,21,24H,15-18,20H2,1-3H3,(H,32,36)
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| InChIKey |
UJCXSFYBPSKBTI-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