(E)-3-(4-bromophenyl)sulfanyl-1-(4-chlorophenyl)prop-2-en-1-one

Formula:C15H10OBrClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)sulfanyl-1-(4-chlorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)sulfanyl-1-(4-chlorophenyl)prop-2-en-1-one
MolecularFormula	C15H10OBrClS
Smiles	O=C(/C=C/Sc(cc1)ccc1Br)c(cc1)ccc1Cl
InChI	InChI=1S/C15H10BrClOS/c16-12-3-7-14(8-4-12)19-10-9-15(18)11-1-5-13(17)6-2-11/h1-10H
InChIK	ATRVPZMUYBKYJW-UHFFFAOYSA-N
TotalMolweight	353.666
Molweight	353.666
MonoisotopicMass	351.932423
CLogP	4.6815
CLogS	-5.798
H Acceptors	1
TotalSurfaceArea	228.81
Relative PSA	0.13343
PolarSurfaceArea	42.37
Druglikeness	-1.3747
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.73684
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	4
StereoCon

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