N-[(Z)-2,1,3-benzoxadiazol-5-ylmethylideneamino]-3-hydroxynaphthalene-2-carboxamide

Formula:C18H12N4O3 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-2,1,3-benzoxadiazol-5-ylmethylideneamino]-3-hydroxynaphthalene-2-carboxamide is a drug-like molecule.

MolName	N-[(Z)-2,1,3-benzoxadiazol-5-ylmethylideneamino]-3-hydroxynaphthalene-2-carboxamide
MolecularFormula	C18H12N4O3
Smiles	Oc1cc2ccccc2cc1C(N/N=C\c1cc2nonc2cc1)=O
InChI	InChI=1S/C18H12N4O3/c23-17-9-13-4-2-1-3-12(13)8-14(17)18(24)20-19-10-11-5-6-15-16(7-11)22-25-21-15/h1-10,23H,(H,20,24)
InChIK	JHTBYCSKROWOOP-UHFFFAOYSA-N
TotalMolweight	332.318
Molweight	332.318
MonoisotopicMass	332.090941
CLogP	4.001
CLogS	-4.67
H Acceptors	7
H Donors	2
TotalSurfaceArea	249.75
Relative PSA	0.34098
PolarSurfaceArea	100.61
Druglikeness	5.7031
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	1
Aromatic Nitrogens	2
StereoCon

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