(Z)-2-(4-chlorobenzoyl)-3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]prop-2-enenitrile

Formula:C23H14NO2Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-(4-chlorobenzoyl)-3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-2-(4-chlorobenzoyl)-3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]prop-2-enenitrile
MolecularFormula	C23H14NO2Cl3
Smiles	N#C/C(/C(c(cc1)ccc1Cl)=O)=C/c(cccc1)c1OCc(c(Cl)ccc1)c1Cl
InChI	InChI=1S/C23H14Cl3NO2/c24-18-10-8-15(9-11-18)23(28)17(13-27)12-16-4-1-2-7-22(16)29-14-19-20(25)5-3-6-21(19)26/h1-12H,14H2
InChIK	ULXXKNCWOCNXDV-UHFFFAOYSA-N
TotalMolweight	442.728
Molweight	442.728
MonoisotopicMass	441.00901
CLogP	6.3219
CLogS	-7.661
H Acceptors	3
TotalSurfaceArea	326.97
Relative PSA	0.11194
PolarSurfaceArea	50.09
Druglikeness	-3.9254
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.55172
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	5
StereoCon

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