General Information of the Compound
| Compound ID |
CP0505426
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| Compound Name |
3-Cyano-4-(3-fluorophenyl)-N-(1-[2-chlorophenyl]-3-phenyl-1H-pyrazol-5-yl)benzamide
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| Structure |
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| Formula |
C29H18ClFN4O
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| Molecular Weight |
492.941
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| Canonical SMILES |
Fc1cccc(c1)-c1ccc(cc1C#N)C(=O)Nc1cc(nn1-c1ccccc1Cl)-c1ccccc1
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| InChI |
InChI=1S/C29H18ClFN4O/c30-25-11-4-5-12-27(25)35-28(17-26(34-35)19-7-2-1-3-8-19)33-29(36)21-13-14-24(22(15-21)18-32)20-9-6-10-23(31)16-20/h1-17H,(H,33,36)
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| InChIKey |
WRLPOVDSSWLTDZ-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