[(E)-[1-amino-2-(4-chlorophenoxy)ethylidene]amino] 2-chloropyridine-4-carboxylate

Formula:C14H11N3O3Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none [(E)-[1-amino-2-(4-chlorophenoxy)ethylidene]amino] 2-chloropyridine-4-carboxylate is a drug-like molecule.

MolName	[(E)-[1-amino-2-(4-chlorophenoxy)ethylidene]amino] 2-chloropyridine-4-carboxylate
MolecularFormula	C14H11N3O3Cl2
Smiles	N/C(/COc(cc1)ccc1Cl)=N/OC(c1cc(Cl)ncc1)=O
InChI	InChI=1S/C14H11Cl2N3O3/c15-10-1-3-11(4-2-10)21-8-13(17)19-22-14(20)9-5-6-18-12(16)7-9/h1-7H,8H2,(H2,17,19)
InChIK	WQFBLIQUKXJKSY-UHFFFAOYSA-N
TotalMolweight	340.165
Molweight	340.165
MonoisotopicMass	339.017746
CLogP	2.9555
CLogS	-3.756
H Acceptors	6
H Donors	1
TotalSurfaceArea	245.62
Relative PSA	0.28821
PolarSurfaceArea	86.8
Druglikeness	-2.7958
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	8
Electronegative Atoms	8
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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1 - [(E)-[1-amino-2-(4-chlorophenoxy)ethylidene]amino] 2-chloropyridine-4-carboxylate | 2 - [(E)-[1-amino-2-(4-chlorophenoxy)ethylidene]amino] 2-chloropyridine-4-carboxylate

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