General Information of the Compound
| Compound ID |
CP0464642
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| Compound Name |
3-[6-(dimethylamino)-4-methylpyridin-3-yl]-2,5-dimethyl-N-(naphthalen-2-ylmethyl)-N-propylpyrazolo[1,5-a]pyrimidin-7-amine
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| Structure |
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| Formula |
C30H34N6
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| Molecular Weight |
478.644
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| Canonical SMILES |
CCCN(Cc1ccc2ccccc2c1)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C
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| InChI |
InChI=1S/C30H34N6/c1-7-14-35(19-23-12-13-24-10-8-9-11-25(24)17-23)28-16-21(3)32-30-29(22(4)33-36(28)30)26-18-31-27(34(5)6)15-20(26)2/h8-13,15-18H,7,14,19H2,1-6H3
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| InChIKey |
KMEIEVDXLDQYLD-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