General Information of the Compound
| Compound ID |
CP0520573
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| Compound Name |
4-[4-(4-chlorophenyl)pyrazol-1-yl]benzamide
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| Structure |
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| Formula |
C16H12ClN3O
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| Molecular Weight |
297.745
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| Canonical SMILES |
NC(=O)c1ccc(cc1)-n1cc(cn1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C16H12ClN3O/c17-14-5-1-11(2-6-14)13-9-19-20(10-13)15-7-3-12(4-8-15)16(18)21/h1-10H,(H2,18,21)
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| InChIKey |
ISMPQCOHFGGZLG-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