[(E)-[amino(pyridin-2-yl)methylidene]amino] 4-(2,4-dichlorophenoxy)butanoate

Formula:C16H15N3O3Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(E)-[amino(pyridin-2-yl)methylidene]amino] 4-(2,4-dichlorophenoxy)butanoate is a drug-like molecule.

MolName	[(E)-[amino(pyridin-2-yl)methylidene]amino] 4-(2,4-dichlorophenoxy)butanoate
MolecularFormula	C16H15N3O3Cl2
Smiles	N/C(/c1ncccc1)=N/OC(CCCOc(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C16H15Cl2N3O3/c17-11-6-7-14(12(18)10-11)23-9-3-5-15(22)24-21-16(19)13-4-1-2-8-20-13/h1-2,4,6-8,10H,3,5,9H2,(H2,19,21)
InChIK	PNQCPIOPGWASOW-UHFFFAOYSA-N
TotalMolweight	368.219
Molweight	368.219
MonoisotopicMass	367.049046
CLogP	3.8209
CLogS	-4.557
H Acceptors	6
H Donors	1
TotalSurfaceArea	273.14
Relative PSA	0.25917
PolarSurfaceArea	86.8
Druglikeness	-8.7293
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.70833
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Aromatic Nitrogens	1
StereoCon

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