General Information of the Compound
| Compound ID |
CP0461073
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| Compound Name |
4-fluoro-N-[(1R,2S)-2-[(3-hydroxyphenyl)methylamino]cyclohexyl]benzamide
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| Structure |
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| Formula |
C20H23FN2O2
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| Molecular Weight |
342.414
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| Canonical SMILES |
Oc1cccc(CN[C@H]2CCCC[C@H]2NC(=O)c2ccc(F)cc2)c1
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| InChI |
InChI=1S/C20H23FN2O2/c21-16-10-8-15(9-11-16)20(25)23-19-7-2-1-6-18(19)22-13-14-4-3-5-17(24)12-14/h3-5,8-12,18-19,22,24H,1-2,6-7,13H2,(H,23,25)/t18-,19+/m0/s1
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| InChIKey |
FUQMITXDOPYWSM-RBUKOAKNSA-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