General Information of the Compound
| Compound ID |
CP0796600
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| Compound Name |
2-(4-Chloro-3-hydroxyphenoxy)pyrido[3,4-d]pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C13H8ClN3O3
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| Molecular Weight |
289.678
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| Canonical SMILES |
O=c1[nH]c(Oc2ccc(Cl)c(O)c2)nc2cnccc12
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| InChI |
InChI=1S/C13H8ClN3O3/c14-9-2-1-7(5-11(9)18)20-13-16-10-6-15-4-3-8(10)12(19)17-13/h1-6,18H,(H,16,17,19)
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| InChIKey |
OZMKCTFOIBLWOO-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