General Information of the Compound
| Compound ID |
CP0535215
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| Compound Name |
N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyphthalazin-1-amine
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| Structure |
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| Formula |
C16H13ClFN3O2
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| Molecular Weight |
333.75
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| Canonical SMILES |
COc1cc2cnnc(Nc3ccc(Cl)cc3F)c2cc1OC
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| InChI |
InChI=1S/C16H13ClFN3O2/c1-22-14-5-9-8-19-21-16(11(9)7-15(14)23-2)20-13-4-3-10(17)6-12(13)18/h3-8H,1-2H3,(H,20,21)
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| InChIKey |
HPCCJDNXFIYPPQ-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