[(E)-[amino-(4-nitrophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate

Formula:C15H11N3O5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(E)-[amino-(4-nitrophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate is a drug-like molecule.

MolName	[(E)-[amino-(4-nitrophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate
MolecularFormula	C15H11N3O5Cl2
Smiles	N/C(/c(cc1)ccc1[N+]([O-])=O)=N/OC(COc(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C15H11Cl2N3O5/c16-10-3-6-13(12(17)7-10)24-8-14(21)25-19-15(18)9-1-4-11(5-2-9)20(22)23/h1-7H,8H2,(H2,18,19)
InChIK	SESXLFWNQAFDQZ-UHFFFAOYSA-N
TotalMolweight	384.174
Molweight	384.174
MonoisotopicMass	383.007576
CLogP	2.9374
CLogS	-5.248
H Acceptors	8
H Donors	1
TotalSurfaceArea	270.53
Relative PSA	0.33357
PolarSurfaceArea	119.73
Druglikeness	-7.5562
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	aromatic nitro
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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