(E)-3-[5-(4-bromophenyl)furan-2-yl]-1-(furan-2-yl)prop-2-en-1-one

Formula:C17H11O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(4-bromophenyl)furan-2-yl]-1-(furan-2-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-[5-(4-bromophenyl)furan-2-yl]-1-(furan-2-yl)prop-2-en-1-one
MolecularFormula	C17H11O3Br
Smiles	O=C(/C=C/c1ccc(-c(cc2)ccc2Br)o1)c1ccco1
InChI	InChI=1S/C17H11BrO3/c18-13-5-3-12(4-6-13)16-10-8-14(21-16)7-9-15(19)17-2-1-11-20-17/h1-11H
InChIK	ORSYIVDUJLVHHP-UHFFFAOYSA-N
TotalMolweight	343.175
Molweight	343.175
MonoisotopicMass	341.989156
CLogP	4.1566
CLogS	-5.816
H Acceptors	3
TotalSurfaceArea	235.04
Relative PSA	0.17554
PolarSurfaceArea	43.35
Druglikeness	-0.09079
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Symmetricatoms	2
StereoCon

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