(Z)-3-[5-(4-bromophenyl)furan-2-yl]-2-(3-chlorophenyl)prop-2-enenitrile

Formula:C19H11NOBrCl Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-3-[5-(4-bromophenyl)furan-2-yl]-2-(3-chlorophenyl)prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-3-[5-(4-bromophenyl)furan-2-yl]-2-(3-chlorophenyl)prop-2-enenitrile
MolecularFormula	C19H11NOBrCl
Smiles	N#C/C(/c1cc(Cl)ccc1)=C\c1ccc(-c(cc2)ccc2Br)o1
InChI	InChI=1S/C19H11BrClNO/c20-16-6-4-13(5-7-16)19-9-8-18(23-19)11-15(12-22)14-2-1-3-17(21)10-14/h1-11H
InChIK	JWOBRQYJZQVNKD-UHFFFAOYSA-N
TotalMolweight	384.659
Molweight	384.659
MonoisotopicMass	382.971252
CLogP	5.6027
CLogS	-6.659
H Acceptors	2
TotalSurfaceArea	262.94
Relative PSA	0.10523
PolarSurfaceArea	36.93
Druglikeness	-5.2829
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	2
StereoCon

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