General Information of the Compound
| Compound ID |
CP0447553
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| Compound Name |
3-chloro-N-[(1S,3S)-3-[(4-methoxybenzoyl)amino]cyclohexyl]benzamide
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| Structure |
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| Formula |
C21H23ClN2O3
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| Molecular Weight |
386.879
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| Canonical SMILES |
COc1ccc(cc1)C(=O)N[C@H]1CCC[C@@H](C1)NC(=O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C21H23ClN2O3/c1-27-19-10-8-14(9-11-19)20(25)23-17-6-3-7-18(13-17)24-21(26)15-4-2-5-16(22)12-15/h2,4-5,8-12,17-18H,3,6-7,13H2,1H3,(H,23,25)(H,24,26)/t17-,18-/m0/s1
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| InChIKey |
QTIGEWLADLHQGT-ROUUACIJSA-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