General Information of the Compound
| Compound ID |
CP0256324
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| Compound Name |
6-[2-chloro-4-(6-methylpyrazin-2-yl)phenyl]-2-(ethylamino)-8-(3-hydroxypropyl)pyrido[2,3-d]pyrimidin-7-one
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| Structure |
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| Formula |
C23H23ClN6O2
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| Molecular Weight |
450.93
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| Canonical SMILES |
CCNc1ncc2cc(-c3ccc(cc3Cl)-c3cncc(C)n3)c(=O)n(CCCO)c2n1
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| InChI |
InChI=1S/C23H23ClN6O2/c1-3-26-23-27-12-16-9-18(22(32)30(7-4-8-31)21(16)29-23)17-6-5-15(10-19(17)24)20-13-25-11-14(2)28-20/h5-6,9-13,31H,3-4,7-8H2,1-2H3,(H,26,27,29)
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| InChIKey |
ICNMDSYSAGMRJC-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