[(E)-[amino-[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]amino] 2,2,2-trichloroacetate

Formula:C16H12N2O3Cl4 Mutagenic:high Tumorigenic:low Reproductive Effective:high [(E)-[amino-[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]amino] 2,2,2-trichloroacetate is not a drug-like molecule.

MolName	[(E)-[amino-[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]amino] 2,2,2-trichloroacetate
MolecularFormula	C16H12N2O3Cl4
Smiles	N/C(/c(cc1)ccc1OCc(cc1)ccc1Cl)=N/OC(C(Cl)(Cl)Cl)=O
InChI	InChI=1S/C16H12Cl4N2O3/c17-12-5-1-10(2-6-12)9-24-13-7-3-11(4-8-13)14(21)22-25-15(23)16(18,19)20/h1-8H,9H2,(H2,21,22)
InChIK	YEJGYCPVLIVUAY-UHFFFAOYSA-N
TotalMolweight	422.094
Molweight	422.094
MonoisotopicMass	419.960201
CLogP	5.0269
CLogS	-5.644
H Acceptors	5
H Donors	1
TotalSurfaceArea	288.11
Relative PSA	0.20763
PolarSurfaceArea	73.91
Druglikeness	-12.23
Mutagenic	high
Tumorigenic	low
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	6
StereoCon

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1 - [(E)-[amino-[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]amino] 2,2,2-trichloroacetate | 2 - [(E)-[amino-[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]amino] 2,2,2-trichloroacetate

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