(2E)-6-[(4-fluorophenyl)methyl]-2-(pyridin-3-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

Formula:C18H11N4O2FS Mutagenic:none Tumorigenic:none Reproductive Effective:none (2E)-6-[(4-fluorophenyl)methyl]-2-(pyridin-3-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione is a drug-like molecule.

MolName	(2E)-6-[(4-fluorophenyl)methyl]-2-(pyridin-3-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
MolecularFormula	C18H11N4O2FS
Smiles	O=C(/C(/SC1=N2)=C\c3cnccc3)N1N=C(Cc(cc1)ccc1F)C2=O
InChI	InChI=1S/C18H11FN4O2S/c19-13-5-3-11(4-6-13)8-14-16(24)21-18-23(22-14)17(25)15(26-18)9-12-2-1-7-20-10-12/h1-7,9-10H,8H2
InChIK	UBPBTMOVVZFJQV-UHFFFAOYSA-N
TotalMolweight	366.375
Molweight	366.375
MonoisotopicMass	366.058674
CLogP	1.8177
CLogS	-4.248
H Acceptors	6
TotalSurfaceArea	258.83
Relative PSA	0.31337
PolarSurfaceArea	100.29
Druglikeness	4.5502
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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1 - (2E)-6-[(4-fluorophenyl)methyl]-2-(pyridin-3-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione | 2 - (2E)-6-[(4-fluorophenyl)methyl]-2-(pyridin-3-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

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