[(E)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 2-phenylacetate

Formula:C16H14N2O2Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:low [(E)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 2-phenylacetate is a drug-like molecule.

MolName	[(E)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 2-phenylacetate
MolecularFormula	C16H14N2O2Cl2
Smiles	N/C(/Cc(ccc(Cl)c1)c1Cl)=N/OC(Cc1ccccc1)=O
InChI	InChI=1S/C16H14Cl2N2O2/c17-13-7-6-12(14(18)10-13)9-15(19)20-22-16(21)8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,19,20)
InChIK	USGAGBVIDLUVQG-UHFFFAOYSA-N
TotalMolweight	337.205
Molweight	337.205
MonoisotopicMass	336.043232
CLogP	4.2803
CLogS	-4.938
H Acceptors	4
H Donors	1
TotalSurfaceArea	250.62
Relative PSA	0.19879
PolarSurfaceArea	64.68
Druglikeness	-3.7395
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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1 - [(E)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 2-phenylacetate | 2 - [(E)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 2-phenylacetate

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