General Information of the Compound
| Compound ID |
CP0016695
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| Compound Name |
2-(5-Benzyl-1H-pyrazol-3-yl)-1H-indole-6-carboxylicacid(2-methyl-2H-pyrazol-3-ylmethyl)-amide
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| Structure |
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| Formula |
C24H22N6O
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| Molecular Weight |
410.481
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| Canonical SMILES |
Cn1nccc1CNC(=O)c1ccc2cc([nH]c2c1)-c1cc(Cc2ccccc2)[nH]n1
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| InChI |
InChI=1S/C24H22N6O/c1-30-20(9-10-26-30)15-25-24(31)18-8-7-17-12-22(27-21(17)13-18)23-14-19(28-29-23)11-16-5-3-2-4-6-16/h2-10,12-14,27H,11,15H2,1H3,(H,25,31)(H,28,29)
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| InChIKey |
UNSQAAWBZNDRBH-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