General Information of the Compound
| Compound ID |
CP0969973
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| Compound Name |
4-chloro-5-(4-(2-ethyl-3-fluorophenoxy)-5,6-dihydropyrido[3,4-d]pyrimidin-7(8H)-yl)pyridazin-3(2H)-one
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| Structure |
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| Formula |
C19H17ClFN5O2
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| Molecular Weight |
401.829
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| Canonical SMILES |
CCc1c(F)cccc1Oc1ncnc2c1CCN(c1cn[nH]c(=O)c1Cl)C2
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| InChI |
InChI=1S/C19H17ClFN5O2/c1-2-11-13(21)4-3-5-16(11)28-19-12-6-7-26(9-14(12)22-10-23-19)15-8-24-25-18(27)17(15)20/h3-5,8,10H,2,6-7,9H2,1H3,(H,25,27)
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| InChIKey |
YRQNOZJAVUWWJH-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