[(E)-[amino-(2-chlorophenyl)methylidene]amino] 2-(2-bromo-4-chlorophenoxy)acetate

Formula:C15H11N2O3BrCl2 Mutagenic:high Tumorigenic:none Reproductive Effective:high [(E)-[amino-(2-chlorophenyl)methylidene]amino] 2-(2-bromo-4-chlorophenoxy)acetate is a drug-like molecule.

MolName	[(E)-[amino-(2-chlorophenyl)methylidene]amino] 2-(2-bromo-4-chlorophenoxy)acetate
MolecularFormula	C15H11N2O3BrCl2
Smiles	N/C(/c(cccc1)c1Cl)=N/OC(COc(ccc(Cl)c1)c1Br)=O
InChI	InChI=1S/C15H11BrCl2N2O3/c16-11-7-9(17)5-6-13(11)22-8-14(21)23-20-15(19)10-3-1-2-4-12(10)18/h1-7H,8H2,(H2,19,20)
InChIK	SURMZQAPTXXMPL-UHFFFAOYSA-N
TotalMolweight	418.073
Molweight	418.073
MonoisotopicMass	415.933008
CLogP	4.5842
CLogS	-5.622
H Acceptors	5
H Donors	1
TotalSurfaceArea	265.49
Relative PSA	0.22532
PolarSurfaceArea	73.91
Druglikeness	-4.3375
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
StereoCon

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1 - [(E)-[amino-(2-chlorophenyl)methylidene]amino] 2-(2-bromo-4-chlorophenoxy)acetate | 2 - [(E)-[amino-(2-chlorophenyl)methylidene]amino] 2-(2-bromo-4-chlorophenoxy)acetate

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