(Z)-N-(4-chlorophenyl)-2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)prop-2-enamide

Formula:C16H9N2O2Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-N-(4-chlorophenyl)-2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)prop-2-enamide is a drug-like molecule.

MolName	(Z)-N-(4-chlorophenyl)-2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)prop-2-enamide
MolecularFormula	C16H9N2O2Cl3
Smiles	N#C/C(/C(Nc(cc1)ccc1Cl)=O)=C/c(cc1Cl)cc(Cl)c1O
InChI	InChI=1S/C16H9Cl3N2O2/c17-11-1-3-12(4-2-11)21-16(23)10(8-20)5-9-6-13(18)15(22)14(19)7-9/h1-7,22H,(H,21,23)
InChIK	XKFVSPIDFSNBGP-UHFFFAOYSA-N
TotalMolweight	367.618
Molweight	367.618
MonoisotopicMass	365.972959
CLogP	4.4606
CLogS	-5.682
H Acceptors	4
H Donors	2
TotalSurfaceArea	261.26
Relative PSA	0.19582
PolarSurfaceArea	73.12
Druglikeness	-1.6896
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	5
Amides	1
StereoCon

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