N'-[(E)-2-(1,3-benzoxazol-2-ylsulfanyl)ethenyl]benzohydrazide

Formula:C16H13N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(E)-2-(1,3-benzoxazol-2-ylsulfanyl)ethenyl]benzohydrazide is a drug-like molecule.

MolName	N'-[(E)-2-(1,3-benzoxazol-2-ylsulfanyl)ethenyl]benzohydrazide
MolecularFormula	C16H13N3O2S
Smiles	O=C(c1ccccc1)NN/C=C/Sc1nc(cccc2)c2o1
InChI	InChI=1S/C16H13N3O2S/c20-15(12-6-2-1-3-7-12)19-17-10-11-22-16-18-13-8-4-5-9-14(13)21-16/h1-11,17H,(H,19,20)
InChIK	GLBQFHXOQQSKAD-UHFFFAOYSA-N
TotalMolweight	311.364
Molweight	311.364
MonoisotopicMass	311.072847
CLogP	2.1482
CLogS	-4.882
H Acceptors	5
H Donors	2
TotalSurfaceArea	240.73
Relative PSA	0.32622
PolarSurfaceArea	92.46
Druglikeness	2.1207
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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