(4-bromo-2-formylphenyl) (E)-3-(furan-2-yl)prop-2-enoate

Formula:C14H9O4Br Mutagenic:high Tumorigenic:none Reproductive Effective:none (4-bromo-2-formylphenyl) (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	(4-bromo-2-formylphenyl) (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C14H9O4Br
Smiles	O=Cc(cc(cc1)Br)c1OC(/C=C/c1ccco1)=O
InChI	InChI=1S/C14H9BrO4/c15-11-3-5-13(10(8-11)9-16)19-14(17)6-4-12-2-1-7-18-12/h1-9H
InChIK	VMUDZRZPIFGRCZ-UHFFFAOYSA-N
TotalMolweight	321.125
Molweight	321.125
MonoisotopicMass	319.968421
CLogP	3.2665
CLogS	-4.296
H Acceptors	4
TotalSurfaceArea	215.13
Relative PSA	0.2333
PolarSurfaceArea	56.51
Druglikeness	-6.9997
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
StereoCon

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