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

Formula:C17H10N4OF2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-(2-fluorophenyl)-2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone is a drug-like molecule.

MolName	1-(2-fluorophenyl)-2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone
MolecularFormula	C17H10N4OF2S
Smiles	O=C(CSc1nnc(c(cc(cc2)F)c2[nH]2)c2n1)c(cccc1)c1F
InChI	InChI=1S/C17H10F2N4OS/c18-9-5-6-13-11(7-9)15-16(20-13)21-17(23-22-15)25-8-14(24)10-3-1-2-4-12(10)19/h1-7H,8H2,(H,20,21,23)
InChIK	PDPYBPQXCGIPSM-UHFFFAOYSA-N
TotalMolweight	356.355
Molweight	356.355
MonoisotopicMass	356.054337
CLogP	3.0007
CLogS	-5.72
H Acceptors	5
H Donors	1
TotalSurfaceArea	249.77
Relative PSA	0.31001
PolarSurfaceArea	96.83
Druglikeness	-0.76203
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	2
Aromatic Nitrogens	4
StereoCon

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

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