General Information of the Compound
Compound ID |
CP0458746
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Compound Name |
N-[(1R,3S)-3-aminocyclohexyl]-2-phenylmethoxy-N-propan-2-ylbenzamide
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Structure |
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Formula |
C23H30N2O2
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Molecular Weight |
366.505
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Canonical SMILES |
CC(C)N([C@@H]1CCC[C@H](N)C1)C(=O)c1ccccc1OCc1ccccc1
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InChI |
InChI=1S/C23H30N2O2/c1-17(2)25(20-12-8-11-19(24)15-20)23(26)21-13-6-7-14-22(21)27-16-18-9-4-3-5-10-18/h3-7,9-10,13-14,17,19-20H,8,11-12,15-16,24H2,1-2H3/t19-,20+/m0/s1
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InChIKey |
HIMBSBQMUNDJAS-VQTJNVASSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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