General Information of the Compound
| Compound ID |
CP0443078
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| Compound Name |
N-[(1R,2S)-2-(3,3-dimethylbutylamino)cyclohexyl]-4-fluorobenzamide
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| Structure |
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| Formula |
C19H29FN2O
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| Molecular Weight |
320.452
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| Canonical SMILES |
CC(C)(C)CCN[C@H]1CCCC[C@H]1NC(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C19H29FN2O/c1-19(2,3)12-13-21-16-6-4-5-7-17(16)22-18(23)14-8-10-15(20)11-9-14/h8-11,16-17,21H,4-7,12-13H2,1-3H3,(H,22,23)/t16-,17+/m0/s1
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| InChIKey |
NIFYKCBXINXWQW-DLBZAZTESA-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