General Information of the Compound
| Compound ID |
CP0157916
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| Compound Name |
N-(2-aminophenyl)-4-(1-{2-[(2-fluorophenyl)carbamoyl]ethyl}piperidin-4-yl)benzamide
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| Structure |
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| Formula |
C27H29FN4O2
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| Molecular Weight |
460.553
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| Canonical SMILES |
Nc1ccccc1NC(=O)c1ccc(cc1)C1CCN(CCC(=O)Nc2ccccc2F)CC1
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| InChI |
InChI=1S/C27H29FN4O2/c28-22-5-1-3-7-24(22)30-26(33)15-18-32-16-13-20(14-17-32)19-9-11-21(12-10-19)27(34)31-25-8-4-2-6-23(25)29/h1-12,20H,13-18,29H2,(H,30,33)(H,31,34)
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| InChIKey |
BMMXYTGQGZIMDY-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