2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide

Formula:C23H16N5OFS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide is a drug-like molecule.

MolName	2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide
MolecularFormula	C23H16N5OFS
Smiles	O=C(CSc1nnc(c(cc(cc2)F)c2[nH]2)c2n1)N(c1ccccc1)c1ccccc1
InChI	InChI=1S/C23H16FN5OS/c24-15-11-12-19-18(13-15)21-22(25-19)26-23(28-27-21)31-14-20(30)29(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,25,26,28)
InChIK	ZJNLFUNBBBLZKI-UHFFFAOYSA-N
TotalMolweight	429.478
Molweight	429.478
MonoisotopicMass	429.105958
CLogP	3.6408
CLogS	-7.06
H Acceptors	6
H Donors	1
TotalSurfaceArea	313.48
Relative PSA	0.25833
PolarSurfaceArea	100.07
Druglikeness	0.85131
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Symmetricatoms	8
Amides	1
Aromatic Nitrogens	4
StereoCon

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1 - 2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide | 2 - 2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide

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