(Z)-2-(3-bromophenyl)-3-phenylprop-2-enenitrile

Formula:C15H10NBr Mutagenic:none Tumorigenic:none Reproductive Effective:high (Z)-2-(3-bromophenyl)-3-phenylprop-2-enenitrile is a drug-like molecule.

MolName	(Z)-2-(3-bromophenyl)-3-phenylprop-2-enenitrile
MolecularFormula	C15H10NBr
Smiles	N#C/C(/c1cccc(Br)c1)=C\c1ccccc1
InChI	InChI=1S/C15H10BrN/c16-15-8-4-7-13(10-15)14(11-17)9-12-5-2-1-3-6-12/h1-10H
InChIK	UTMZDQWDIFQAAW-UHFFFAOYSA-N
TotalMolweight	284.155
Molweight	284.155
MonoisotopicMass	282.99966
CLogP	4.0578
CLogS	-4.463
H Acceptors	1
TotalSurfaceArea	198.07
Relative PSA	0.068461
PolarSurfaceArea	23.79
Druglikeness	-6.8698
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.58824
Fragments	1
Non HAtoms	17
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
StereoCon

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