[(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] 2-(2-chlorophenoxy)acetate

Formula:C20H17N2O3Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none [(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] 2-(2-chlorophenoxy)acetate is a drug-like molecule.

MolName	[(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] 2-(2-chlorophenoxy)acetate
MolecularFormula	C20H17N2O3Cl
Smiles	N/C(/Cc1cccc2ccccc12)=N/OC(COc(cccc1)c1Cl)=O
InChI	InChI=1S/C20H17ClN2O3/c21-17-10-3-4-11-18(17)25-13-20(24)26-23-19(22)12-15-8-5-7-14-6-1-2-9-16(14)15/h1-11H,12-13H2,(H2,22,23)
InChIK	OOLDLCYVRJPAGK-UHFFFAOYSA-N
TotalMolweight	368.819
Molweight	368.819
MonoisotopicMass	368.09277
CLogP	4.4455
CLogS	-5.623
H Acceptors	5
H Donors	1
TotalSurfaceArea	279.8
Relative PSA	0.2138
PolarSurfaceArea	73.91
Druglikeness	-2.5918
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	4
StereoCon

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1 - [(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] 2-(2-chlorophenoxy)acetate | 2 - [(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] 2-(2-chlorophenoxy)acetate

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