General Information of the Compound
| Compound ID |
CP0639361
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| Compound Name |
4-(5-Methylpyridin-2-yl)-1-p-tolyl-1H-indazole-6-carboxylic acid (5-methylpyrazin-2-ylmethyl)amide
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| Structure |
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| Formula |
C27H24N6O
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| Molecular Weight |
448.53
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| Canonical SMILES |
Cc1ccc(-n2ncc3c(-c4ccc(C)cn4)cc(C(=O)NCc4cnc(C)cn4)cc32)cc1
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| InChI |
InChI=1S/C27H24N6O/c1-17-4-7-22(8-5-17)33-26-11-20(27(34)31-15-21-14-28-19(3)13-29-21)10-23(24(26)16-32-33)25-9-6-18(2)12-30-25/h4-14,16H,15H2,1-3H3,(H,31,34)
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| InChIKey |
IKPGHRSYEVJPTH-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