General Information of the Compound
| Compound ID |
CP0561946
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| Compound Name |
(2S)-2-(2,5-dichlorophenoxy)-N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]propanamide
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| Structure |
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| Formula |
C19H12Cl2F3NO4
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| Molecular Weight |
446.208
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| Canonical SMILES |
C[C@H](Oc1cc(Cl)ccc1Cl)C(=O)Nc1ccc2c(cc(=O)oc2c1)C(F)(F)F
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| InChI |
InChI=1S/C19H12Cl2F3NO4/c1-9(28-16-6-10(20)2-5-14(16)21)18(27)25-11-3-4-12-13(19(22,23)24)8-17(26)29-15(12)7-11/h2-9H,1H3,(H,25,27)/t9-/m0/s1
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| InChIKey |
ONYYOXQBBGVBPH-VIFPVBQESA-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