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

Formula:C15H10OBrCl Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-1-(2-bromophenyl)-3-(2-chlorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(2-bromophenyl)-3-(2-chlorophenyl)prop-2-en-1-one
MolecularFormula	C15H10OBrCl
Smiles	O=C(/C=C/c(cccc1)c1Cl)c(cccc1)c1Br
InChI	InChI=1S/C15H10BrClO/c16-13-7-3-2-6-12(13)15(18)10-9-11-5-1-4-8-14(11)17/h1-10H
InChIK	KYGASODUTVBESU-UHFFFAOYSA-N
TotalMolweight	321.6
Molweight	321.6
MonoisotopicMass	319.960353
CLogP	4.635
CLogS	-5.41
H Acceptors	1
TotalSurfaceArea	211.32
Relative PSA	0.061707
PolarSurfaceArea	17.07
Druglikeness	-1.5923
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
StereoCon

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