General Information of the Compound
Compound ID |
CP0390987
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Compound Name |
6-(propylamino)-4-(trifluoromethyl)-1,2-dihydroquinolin-2-one
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Synonyms |
4-(Trifluoromethyl)-6-(propylamino)quinoline-2(1H)-one
6-N-propyl -4-trifluoromethylquinolin-2(1H)-one
6-dialkylamino-4-trifluoromethylquinolin-2(1H)-one, 4a
BDBM18527
CHEMBL405835
SCHEMBL1771502
ZINC14968235
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Structure |
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Formula |
C13H13F3N2O
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Molecular Weight |
270.254
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Canonical SMILES |
CCCNc1ccc2[nH]c(=O)cc(c2c1)C(F)(F)F
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InChI |
InChI=1S/C13H13F3N2O/c1-2-5-17-8-3-4-11-9(6-8)10(13(14,15)16)7-12(19)18-11/h3-4,6-7,17H,2,5H2,1H3,(H,18,19)
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InChIKey |
YGYHGNGCPLCHQH-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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
Clinical Information about the Compound