General Information of the Compound
| Compound ID |
CP0427439
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| Compound Name |
8-[6-[3-(dimethylamino)propoxy]pyridin-3-yl]-3-methyl-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one
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| Structure |
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| Formula |
C25H30N6O3
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| Molecular Weight |
462.554
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| Canonical SMILES |
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
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| InChI |
InChI=1S/C25H30N6O3/c1-29(2)11-4-12-34-22-8-5-17(15-27-22)19-6-7-20-23(28-19)24-21(16-26-20)30(3)25(32)31(24)18-9-13-33-14-10-18/h5-8,15-16,18H,4,9-14H2,1-3H3
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| InChIKey |
XHCNMBWTZBEPEW-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
Protein ID: PT01902, Serine-protein kinase ATM
Protein ID: PT01934, Serine/threonine-protein kinase ATR