General Information of the Compound
| Compound ID |
CP0580162
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| Compound Name |
N,N-dimethyl-2-[4-[4-[[6-methyl-4-[(1-methylcyclopropyl)amino]-5-oxopyrido[4,3-d]pyrimidin-2-yl]amino]pyrazol-1-yl]piperidin-1-yl]acetamide
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| Structure |
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| Formula |
C24H33N9O2
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| Molecular Weight |
479.589
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| Canonical SMILES |
CN(C)C(=O)CN1CCC(CC1)n1cc(Nc2nc(NC3(C)CC3)c3c(ccn(C)c3=O)n2)cn1
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| InChI |
InChI=1S/C24H33N9O2/c1-24(8-9-24)29-21-20-18(7-10-31(4)22(20)35)27-23(28-21)26-16-13-25-33(14-16)17-5-11-32(12-6-17)15-19(34)30(2)3/h7,10,13-14,17H,5-6,8-9,11-12,15H2,1-4H3,(H2,26,27,28,29)
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| InChIKey |
KRYHJTOBGCFKNN-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