General Information of the Compound
| Compound ID |
CP0458745
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| Compound Name |
N-[(1R,3S)-3-aminocyclohexyl]-N-cyclobutyl-2-phenylmethoxybenzamide
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| Structure |
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| Formula |
C24H30N2O2
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| Molecular Weight |
378.516
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| Canonical SMILES |
N[C@H]1CCC[C@H](C1)N(C1CCC1)C(=O)c1ccccc1OCc1ccccc1
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| InChI |
InChI=1S/C24H30N2O2/c25-19-10-6-13-21(16-19)26(20-11-7-12-20)24(27)22-14-4-5-15-23(22)28-17-18-8-2-1-3-9-18/h1-5,8-9,14-15,19-21H,6-7,10-13,16-17,25H2/t19-,21+/m0/s1
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| InChIKey |
JTCQVKZVLAAVDY-PZJWPPBQSA-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