(E)-N-[(4-fluorophenyl)methoxy]-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-imine

Formula:C13H12N3O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[(4-fluorophenyl)methoxy]-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-imine is a drug-like molecule.

MolName	(E)-N-[(4-fluorophenyl)methoxy]-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-imine
MolecularFormula	C13H12N3O2F
Smiles	Fc1ccc(CO/N=C2/c3nonc3CCC2)cc1
InChI	InChI=1S/C13H12FN3O2/c14-10-6-4-9(5-7-10)8-18-15-11-2-1-3-12-13(11)17-19-16-12/h4-7H,1-3,8H2
InChIK	CDWIRMXWQBGHDX-UHFFFAOYSA-N
TotalMolweight	261.255
Molweight	261.255
MonoisotopicMass	261.091355
CLogP	3.2285
CLogS	-3.196
H Acceptors	5
TotalSurfaceArea	201.09
Relative PSA	0.28624
PolarSurfaceArea	60.51
Druglikeness	-2.9368
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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