[(E)-[1-amino-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethylidene]amino] 4-chlorobenzoate

Formula:C17H13N4O4Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none [(E)-[1-amino-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethylidene]amino] 4-chlorobenzoate is a drug-like molecule.

MolName	[(E)-[1-amino-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethylidene]amino] 4-chlorobenzoate
MolecularFormula	C17H13N4O4Cl
Smiles	N/C(/COc(cc1)ccc1-c1nnco1)=N/OC(c(cc1)ccc1Cl)=O
InChI	InChI=1S/C17H13ClN4O4/c18-13-5-1-12(2-6-13)17(23)26-22-15(19)9-24-14-7-3-11(4-8-14)16-21-20-10-25-16/h1-8,10H,9H2,(H2,19,22)
InChIK	CSJSNLMRDSRLIV-UHFFFAOYSA-N
TotalMolweight	372.767
Molweight	372.767
MonoisotopicMass	372.062533
CLogP	3.0781
CLogS	-5.781
H Acceptors	8
H Donors	1
TotalSurfaceArea	278.41
Relative PSA	0.34435
PolarSurfaceArea	112.83
Druglikeness	-1.7662
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.69231
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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1 - [(E)-[1-amino-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethylidene]amino] 4-chlorobenzoate | 2 - [(E)-[1-amino-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethylidene]amino] 4-chlorobenzoate

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