(5Z)-5-benzylidene-3-phenyl-1,2-dihydro-1,2,4-triazin-6-one

Formula:C16H13N3O Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-benzylidene-3-phenyl-1,2-dihydro-1,2,4-triazin-6-one is a drug-like molecule.

MolName	(5Z)-5-benzylidene-3-phenyl-1,2-dihydro-1,2,4-triazin-6-one
MolecularFormula	C16H13N3O
Smiles	O=C1NNC(c2ccccc2)=N/C1=C\c1ccccc1
InChI	InChI=1S/C16H13N3O/c20-16-14(11-12-7-3-1-4-8-12)17-15(18-19-16)13-9-5-2-6-10-13/h1-11H,(H,17,18)(H,19,20)
InChIK	CIBSDTJVSDOTJL-UHFFFAOYSA-N
TotalMolweight	263.299
Molweight	263.299
MonoisotopicMass	263.105862
CLogP	1.1486
CLogS	-4.02
H Acceptors	4
H Donors	2
TotalSurfaceArea	207.87
Relative PSA	0.22836
PolarSurfaceArea	53.49
Druglikeness	3.2685
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	4
BasicNitrogens	1
StereoCon

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