General Information of the Compound
| Compound ID |
CP0413869
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| Compound Name |
N-[(1R,3S)-3-aminocyclohexyl]-N-butyl-2-phenylmethoxybenzamide
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| Structure |
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| Formula |
C24H32N2O2
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| Molecular Weight |
380.532
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| Canonical SMILES |
CCCCN([C@@H]1CCC[C@H](N)C1)C(=O)c1ccccc1OCc1ccccc1
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| InChI |
InChI=1S/C24H32N2O2/c1-2-3-16-26(21-13-9-12-20(25)17-21)24(27)22-14-7-8-15-23(22)28-18-19-10-5-4-6-11-19/h4-8,10-11,14-15,20-21H,2-3,9,12-13,16-18,25H2,1H3/t20-,21+/m0/s1
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| InChIKey |
RTRHTCWGEOBUPY-LEWJYISDSA-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