General Information of the Compound
| Compound ID |
CP0399186
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| Compound Name |
1-[(5-chloro-2-phenylmethoxyphenyl)methyl]-5-methyl-N-phenylpyrazole-3-carboxamide
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| Structure |
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| Formula |
C25H22ClN3O2
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| Molecular Weight |
431.923
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| Canonical SMILES |
Cc1cc(nn1Cc1cc(Cl)ccc1OCc1ccccc1)C(=O)Nc1ccccc1
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| InChI |
InChI=1S/C25H22ClN3O2/c1-18-14-23(25(30)27-22-10-6-3-7-11-22)28-29(18)16-20-15-21(26)12-13-24(20)31-17-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,27,30)
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| InChIKey |
UOLPNGSLHSUNBF-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