General Information of the Compound
| Compound ID |
CP0634693
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| Compound Name |
1-Benzyl-4-(5-methylpyridin-2-yl)-1H-indazole-6-carboxylic acid ((S)-2-hydroxy-1-methylethyl)amide
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| Structure |
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| Formula |
C24H24N4O2
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| Molecular Weight |
400.482
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| Canonical SMILES |
Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc3c2cnn3Cc2ccccc2)nc1
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| InChI |
InChI=1S/C24H24N4O2/c1-16-8-9-22(25-12-16)20-10-19(24(30)27-17(2)15-29)11-23-21(20)13-26-28(23)14-18-6-4-3-5-7-18/h3-13,17,29H,14-15H2,1-2H3,(H,27,30)/t17-/m0/s1
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| InChIKey |
RFDNTGJGXJPZQD-KRWDZBQOSA-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