General Information of the Compound
| Compound ID |
CP0103457
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| Compound Name |
cyclohexylmethyl N-[3-[4-(trifluoromethyl)phenyl]phenyl]carbamate
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| Structure |
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| Formula |
C21H22F3NO2
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| Molecular Weight |
377.406
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-c1cccc(NC(=O)OCC2CCCCC2)c1
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| InChI |
InChI=1S/C21H22F3NO2/c22-21(23,24)18-11-9-16(10-12-18)17-7-4-8-19(13-17)25-20(26)27-14-15-5-2-1-3-6-15/h4,7-13,15H,1-3,5-6,14H2,(H,25,26)
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| InChIKey |
KANGZIKEODWWSS-UHFFFAOYSA-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