[(E)-[amino(pyridin-4-yl)methylidene]amino] 2-(2-chlorophenoxy)acetate

Formula:C14H12N3O3Cl Mutagenic:high Tumorigenic:none Reproductive Effective:none [(E)-[amino(pyridin-4-yl)methylidene]amino] 2-(2-chlorophenoxy)acetate is a drug-like molecule.

MolName	[(E)-[amino(pyridin-4-yl)methylidene]amino] 2-(2-chlorophenoxy)acetate
MolecularFormula	C14H12N3O3Cl
Smiles	N/C(/c1ccncc1)=N/OC(COc(cccc1)c1Cl)=O
InChI	InChI=1S/C14H12ClN3O3/c15-11-3-1-2-4-12(11)20-9-13(19)21-18-14(16)10-5-7-17-8-6-10/h1-8H,9H2,(H2,16,18)
InChIK	IFZDNXDBIFDJCS-UHFFFAOYSA-N
TotalMolweight	305.72
Molweight	305.72
MonoisotopicMass	305.056719
CLogP	2.2521
CLogS	-3.257
H Acceptors	6
H Donors	1
TotalSurfaceArea	230.2
Relative PSA	0.30752
PolarSurfaceArea	86.8
Druglikeness	-2.5475
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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