(E)-3-(5-bromofuran-2-yl)-1-(furan-2-yl)prop-2-en-1-one

Formula:C11H7O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(5-bromofuran-2-yl)-1-(furan-2-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(5-bromofuran-2-yl)-1-(furan-2-yl)prop-2-en-1-one
MolecularFormula	C11H7O3Br
Smiles	O=C(/C=C/c(o1)ccc1Br)c1ccco1
InChI	InChI=1S/C11H7BrO3/c12-11-6-4-8(15-11)3-5-9(13)10-2-1-7-14-10/h1-7H
InChIK	GLJSEFIOYCECBB-UHFFFAOYSA-N
TotalMolweight	267.078
Molweight	267.078
MonoisotopicMass	265.957856
CLogP	2.5038
CLogS	-3.801
H Acceptors	3
TotalSurfaceArea	175.28
Relative PSA	0.23539
PolarSurfaceArea	43.35
Druglikeness	-1.6008
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	15
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
StereoCon

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