(E)-2-(4-chlorophenyl)-3-(2-hydroxyanilino)prop-2-enenitrile

Formula:C15H11N2OCl Mutagenic:none Tumorigenic:low Reproductive Effective:low (E)-2-(4-chlorophenyl)-3-(2-hydroxyanilino)prop-2-enenitrile is a drug-like molecule.

MolName	(E)-2-(4-chlorophenyl)-3-(2-hydroxyanilino)prop-2-enenitrile
MolecularFormula	C15H11N2OCl
Smiles	N#C/C(/c(cc1)ccc1Cl)=C/Nc(cccc1)c1O
InChI	InChI=1S/C15H11ClN2O/c16-13-7-5-11(6-8-13)12(9-17)10-18-14-3-1-2-4-15(14)19/h1-8,10,18-19H
InChIK	GRNRVVBAAGLOLZ-UHFFFAOYSA-N
TotalMolweight	270.718
Molweight	270.718
MonoisotopicMass	270.05599
CLogP	2.7636
CLogS	-4.015
H Acceptors	3
H Donors	2
TotalSurfaceArea	212.67
Relative PSA	0.17924
PolarSurfaceArea	56.05
Druglikeness	-4.6695
Mutagenic	none
Tumorigenic	low
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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