General Information of the Compound
| Compound ID |
CP0453123
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| Compound Name |
5-Methyl-1-m-tolyl-1H-pyrazole-3-carboxylic acid (3,5-dichloro-phenyl)-amide
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| Structure |
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| Formula |
C18H15Cl2N3O
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| Molecular Weight |
360.244
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| Canonical SMILES |
Cc1cc(nn1-c1cccc(C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1
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| InChI |
InChI=1S/C18H15Cl2N3O/c1-11-4-3-5-16(6-11)23-12(2)7-17(22-23)18(24)21-15-9-13(19)8-14(20)10-15/h3-10H,1-2H3,(H,21,24)
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| InChIKey |
VYMKTQXARNDROF-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