General Information of the Compound
| Compound ID |
CP0572060
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| Compound Name |
2-[[1-(2-methyl-2-azaspiro[3.3]heptan-6-yl)pyrazol-4-yl]amino]-4-[(1-methylcyclopropyl)amino]-6-(1-methyltriazol-4-yl)pyrido[4,3-d]pyrimidin-5-one
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| Structure |
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| Formula |
C24H29N11O
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| Molecular Weight |
487.572
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| Canonical SMILES |
CN1CC2(CC(C2)n2cc(Nc3nc(NC4(C)CC4)c4c(ccn(-c5cn(C)nn5)c4=O)n3)cn2)C1
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| InChI |
InChI=1S/C24H29N11O/c1-23(5-6-23)29-20-19-17(4-7-34(21(19)36)18-12-33(3)31-30-18)27-22(28-20)26-15-10-25-35(11-15)16-8-24(9-16)13-32(2)14-24/h4,7,10-12,16H,5-6,8-9,13-14H2,1-3H3,(H2,26,27,28,29)
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| InChIKey |
IUDOKPJBZNRNCM-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