General Information of the Compound
| Compound ID |
CP0545785
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| Compound Name |
4-fluoro-N-[3-(propylamino)-5-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C17H16F4N2O
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| Molecular Weight |
340.32
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| Canonical SMILES |
CCCNc1cc(NC(=O)c2ccc(F)cc2)cc(c1)C(F)(F)F
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| InChI |
InChI=1S/C17H16F4N2O/c1-2-7-22-14-8-12(17(19,20)21)9-15(10-14)23-16(24)11-3-5-13(18)6-4-11/h3-6,8-10,22H,2,7H2,1H3,(H,23,24)
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| InChIKey |
FJEQNXSKGGBBDD-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