General Information of the Compound
| Compound ID |
CP0512481
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| Compound Name |
N-[[4-(1H-indazol-5-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-yl]methyl]-3-methylaniline
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| Formula |
C24H22N6
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| Molecular Weight |
394.482
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| Canonical SMILES |
Cc1cccc(NCc2nc(c([nH]2)-c2cccc(C)n2)-c2ccc3[nH]ncc3c2)c1
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| InChI |
InChI=1S/C24H22N6/c1-15-5-3-7-19(11-15)25-14-22-28-23(17-9-10-20-18(12-17)13-26-30-20)24(29-22)21-8-4-6-16(2)27-21/h3-13,25H,14H2,1-2H3,(H,26,30)(H,28,29)
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| InChIKey |
GXSVCLUDQARGGX-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