General Information of the Compound
| Compound ID |
CP0638345
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| Compound Name |
1-(3-Methylbutyl)-4-(5-methylpyridin-2-yl)-1H-indazole-6-carboxylic acid-(5-methylpyrazin-2-ylmethyl)amide
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| Structure |
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| Formula |
C25H28N6O
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| Molecular Weight |
428.54
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| Canonical SMILES |
Cc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc3c2cnn3CCC(C)C)nc1
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| InChI |
InChI=1S/C25H28N6O/c1-16(2)7-8-31-24-10-19(25(32)29-14-20-13-26-18(4)12-27-20)9-21(22(24)15-30-31)23-6-5-17(3)11-28-23/h5-6,9-13,15-16H,7-8,14H2,1-4H3,(H,29,32)
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| InChIKey |
JYDDCTCHITXHNX-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