General Information of the Compound
| Compound ID |
CP0156449
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| Compound Name |
3-[4-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]-N-[(6-methylpyridin-3-yl)methyl]benzamide
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| Structure |
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| Formula |
C24H21ClN6O2
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| Molecular Weight |
460.925
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| Canonical SMILES |
Cc1ccc(CNC(=O)c2cccc(c2)-n2cc(NC(=O)Nc3ccccc3Cl)cn2)cn1
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| InChI |
InChI=1S/C24H21ClN6O2/c1-16-9-10-17(12-26-16)13-27-23(32)18-5-4-6-20(11-18)31-15-19(14-28-31)29-24(33)30-22-8-3-2-7-21(22)25/h2-12,14-15H,13H2,1H3,(H,27,32)(H2,29,30,33)
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| InChIKey |
OYICHVOOWWQYDE-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