General Information of the Compound
| Compound ID |
CP0555285
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| Compound Name |
N-[3-chloro-4-(trifluoromethoxy)phenyl]-2-(3-cyclopropyl-4-oxophthalazin-1-yl)acetamide
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| Structure |
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| Formula |
C20H15ClF3N3O3
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| Molecular Weight |
437.805
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| Canonical SMILES |
FC(F)(F)Oc1ccc(NC(=O)Cc2nn(C3CC3)c(=O)c3ccccc23)cc1Cl
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| InChI |
InChI=1S/C20H15ClF3N3O3/c21-15-9-11(5-8-17(15)30-20(22,23)24)25-18(28)10-16-13-3-1-2-4-14(13)19(29)27(26-16)12-6-7-12/h1-5,8-9,12H,6-7,10H2,(H,25,28)
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| InChIKey |
ABVFVDOETADVTL-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