General Information of the Compound
| Compound ID |
CP0399549
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| Compound Name |
N-(2,5-dichlorophenyl)-3-phenyl-1H-pyrazole-5-carboxamide
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| Structure |
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| Formula |
C16H11Cl2N3O
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| Molecular Weight |
332.19
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| Canonical SMILES |
Clc1ccc(Cl)c(NC(=O)c2cc([nH]n2)-c2ccccc2)c1
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| InChI |
InChI=1S/C16H11Cl2N3O/c17-11-6-7-12(18)14(8-11)19-16(22)15-9-13(20-21-15)10-4-2-1-3-5-10/h1-9H,(H,19,22)(H,20,21)
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| InChIKey |
YQSLWZWTPSITSZ-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