2-[[2,6-dichloro-4-[(Z)-hydroxyiminomethyl]phenoxy]methyl]benzonitrile

Formula:C15H10N2O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[2,6-dichloro-4-[(Z)-hydroxyiminomethyl]phenoxy]methyl]benzonitrile is a drug-like molecule.

MolName	2-[[2,6-dichloro-4-[(Z)-hydroxyiminomethyl]phenoxy]methyl]benzonitrile
MolecularFormula	C15H10N2O2Cl2
Smiles	N#Cc1c(COc(c(Cl)cc(/C=N\O)c2)c2Cl)cccc1
InChI	InChI=1S/C15H10Cl2N2O2/c16-13-5-10(8-19-20)6-14(17)15(13)21-9-12-4-2-1-3-11(12)7-18/h1-6,8,20H,9H2
InChIK	OFZQGTCTFGVUGR-UHFFFAOYSA-N
TotalMolweight	321.162
Molweight	321.162
MonoisotopicMass	320.011932
CLogP	4.61
CLogS	-5.901
H Acceptors	4
H Donors	1
TotalSurfaceArea	240.44
Relative PSA	0.20034
PolarSurfaceArea	65.61
Druglikeness	-5.4122
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61905
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	3
StereoCon

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