General Information of the Compound
| Compound ID |
CP0495151
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| Compound Name |
N-[1-[4-cyano-3-(trifluoromethyl)phenyl]pyrazol-3-yl]-4-fluorobenzamide
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| Structure |
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| Formula |
C18H10F4N4O
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| Molecular Weight |
374.297
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)Nc1ccn(n1)-c1ccc(C#N)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C18H10F4N4O/c19-13-4-1-11(2-5-13)17(27)24-16-7-8-26(25-16)14-6-3-12(10-23)15(9-14)18(20,21)22/h1-9H,(H,24,25,27)
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| InChIKey |
QPQFWQXNBDIUPC-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