General Information of the Compound
| Compound ID |
CP0577162
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| Compound Name |
6-methyl-4-[(1-methylcyclopropyl)amino]-2-[[1-(1-methyl-6-oxopiperidin-3-yl)pyrazol-4-yl]amino]pyrido[4,3-d]pyrimidin-5-one
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| Structure |
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| Formula |
C21H26N8O2
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| Molecular Weight |
422.493
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| Canonical SMILES |
CN1CC(CCC1=O)n1cc(Nc2nc(NC3(C)CC3)c3c(ccn(C)c3=O)n2)cn1
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| InChI |
InChI=1S/C21H26N8O2/c1-21(7-8-21)26-18-17-15(6-9-27(2)19(17)31)24-20(25-18)23-13-10-22-29(11-13)14-4-5-16(30)28(3)12-14/h6,9-11,14H,4-5,7-8,12H2,1-3H3,(H2,23,24,25,26)
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| InChIKey |
ZIDQVHAUJXUJDV-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