6-bromo-3-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Formula:C24H15NO2BrF Mutagenic:none Tumorigenic:none Reproductive Effective:high 6-bromo-3-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one is a drug-like molecule.

MolName	6-bromo-3-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one
MolecularFormula	C24H15NO2BrF
Smiles	O=C(/C=C/c(cc1)ccc1F)C1=C(c2ccccc2)c(cc(cc2)Br)c2NC1=O
InChI	InChI=1S/C24H15BrFNO2/c25-17-9-12-20-19(14-17)22(16-4-2-1-3-5-16)23(24(29)27-20)21(28)13-8-15-6-10-18(26)11-7-15/h1-14H,(H,27,29)
InChIK	PZJIBQIIMGYKNA-UHFFFAOYSA-N
TotalMolweight	448.29
Molweight	448.29
MonoisotopicMass	447.027018
CLogP	4.8858
CLogS	-6.351
H Acceptors	3
H Donors	1
TotalSurfaceArea	300.64
Relative PSA	0.12487
PolarSurfaceArea	46.17
Druglikeness	0.54218
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Symmetricatoms	4
Amides	1
StereoCon

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