General Information of the Compound
| Compound ID |
CP0462587
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| Compound Name |
N-[(1R)-2-[4-(4-chlorophenyl)piperidin-1-yl]-1-cyclohexyl-2-oxoethyl]benzamide
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| Structure |
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| Formula |
C26H31ClN2O2
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| Molecular Weight |
438.999
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| Canonical SMILES |
Clc1ccc(cc1)C1CCN(CC1)C(=O)[C@H](NC(=O)c1ccccc1)C1CCCCC1
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| InChI |
InChI=1S/C26H31ClN2O2/c27-23-13-11-19(12-14-23)20-15-17-29(18-16-20)26(31)24(21-7-3-1-4-8-21)28-25(30)22-9-5-2-6-10-22/h2,5-6,9-14,20-21,24H,1,3-4,7-8,15-18H2,(H,28,30)/t24-/m1/s1
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| InChIKey |
MFMVJSBNKQSLTA-XMMPIXPASA-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