(E)-3-(4-bromophenyl)sulfonyl-1-(4-fluorophenyl)prop-2-en-1-one

Formula:C15H10O3BrFS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)sulfonyl-1-(4-fluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)sulfonyl-1-(4-fluorophenyl)prop-2-en-1-one
MolecularFormula	C15H10O3BrFS
Smiles	O=C(/C=C/S(c(cc1)ccc1Br)(=O)=O)c(cc1)ccc1F
InChI	InChI=1S/C15H10BrFO3S/c16-12-3-7-14(8-4-12)21(19,20)10-9-15(18)11-1-5-13(17)6-2-11/h1-10H
InChIK	CBHAXJVJSBISQK-UHFFFAOYSA-N
TotalMolweight	369.209
Molweight	369.209
MonoisotopicMass	367.951804
CLogP	2.7011
CLogS	-4.945
H Acceptors	3
TotalSurfaceArea	230.83
Relative PSA	0.18031
PolarSurfaceArea	59.59
Druglikeness	-0.57456
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	5
StereoCon

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