General Information of the Compound
| Compound ID |
CP0247834
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| Compound Name |
7-[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]carbamoylamino]-N-methyl-N-(2-pyridin-2-ylethyl)-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C32H35N7O2
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| Molecular Weight |
549.679
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| Canonical SMILES |
CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1
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| InChI |
InChI=1S/C32H35N7O2/c1-21-12-14-24(15-13-21)39-28(20-27(37-39)32(2,3)4)36-31(41)35-25-11-8-9-22-19-26(34-29(22)25)30(40)38(5)18-16-23-10-6-7-17-33-23/h6-15,17,19-20,34H,16,18H2,1-5H3,(H2,35,36,41)
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| InChIKey |
AASJEUHBEWXQIG-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