2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide

Formula:C16H15N6OFS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide is a drug-like molecule.

MolName	2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide
MolecularFormula	C16H15N6OFS
Smiles	Cc(ccc(NC(CSc1nnc(-c2ccncc2)n1N)=O)c1)c1F
InChI	InChI=1S/C16H15FN6OS/c1-10-2-3-12(8-13(10)17)20-14(24)9-25-16-22-21-15(23(16)18)11-4-6-19-7-5-11/h2-8H,9,18H2,1H3,(H,20,24)
InChIK	QYOHNUKRVHFPOL-UHFFFAOYSA-N
TotalMolweight	358.4
Molweight	358.4
MonoisotopicMass	358.101207
CLogP	2.1412
CLogS	-6.781
H Acceptors	7
H Donors	2
TotalSurfaceArea	265.85
Relative PSA	0.36502
PolarSurfaceArea	124.02
Druglikeness	-0.1955
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	4
StereoCon

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