2-[(Z)-2-hydroxy-2-phenylethenyl]sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Formula:C19H15N2OF3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-2-hydroxy-2-phenylethenyl]sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile is a drug-like molecule.

MolName	2-[(Z)-2-hydroxy-2-phenylethenyl]sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
MolecularFormula	C19H15N2OF3S
Smiles	N#Cc1c(C(F)(F)F)c(CCCC2)c2nc1S/C=C(/c1ccccc1)\O
InChI	InChI=1S/C19H15F3N2OS/c20-19(21,22)17-13-8-4-5-9-15(13)24-18(14(17)10-23)26-11-16(25)12-6-2-1-3-7-12/h1-3,6-7,11,25H,4-5,8-9H2
InChIK	KRGUKYWPAXUBFY-UHFFFAOYSA-N
TotalMolweight	376.401
Molweight	376.401
MonoisotopicMass	376.085717
CLogP	4.1992
CLogS	-5.308
H Acceptors	3
H Donors	1
TotalSurfaceArea	273.04
Relative PSA	0.20188
PolarSurfaceArea	82.21
Druglikeness	-17.403
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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1 - 2-[(Z)-2-hydroxy-2-phenylethenyl]sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile | 2 - 2-[(Z)-2-hydroxy-2-phenylethenyl]sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

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