General Information of the Compound
| Compound ID |
CP0383853
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| Compound Name |
1-(2-chlorophenyl)-5-(4-chlorophenyl)-4-(cyanomethyl)-N-(4-fluorophenyl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C24H15Cl2FN4O
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| Molecular Weight |
465.315
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| Canonical SMILES |
Fc1ccc(NC(=O)c2nn(c(c2CC#N)-c2ccc(Cl)cc2)-c2ccccc2Cl)cc1
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| InChI |
InChI=1S/C24H15Cl2FN4O/c25-16-7-5-15(6-8-16)23-19(13-14-28)22(24(32)29-18-11-9-17(27)10-12-18)30-31(23)21-4-2-1-3-20(21)26/h1-12H,13H2,(H,29,32)
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| InChIKey |
UQTAUKFNHKTXIB-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