(E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile

Formula:C19H10N2F4S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile is a drug-like molecule.

MolName	(E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile
MolecularFormula	C19H10N2F4S
Smiles	N#C/C(/c1nc(-c(cc2)ccc2F)cs1)=C\c1c(C(F)(F)F)cccc1
InChI	InChI=1S/C19H10F4N2S/c20-15-7-5-12(6-8-15)17-11-26-18(25-17)14(10-24)9-13-3-1-2-4-16(13)19(21,22)23/h1-9,11H
InChIK	MQILKQLIPRELIO-UHFFFAOYSA-N
TotalMolweight	374.36
Molweight	374.36
MonoisotopicMass	374.05008
CLogP	4.862
CLogS	-5.529
H Acceptors	2
TotalSurfaceArea	269.71
Relative PSA	0.16644
PolarSurfaceArea	64.92
Druglikeness	-8.8405
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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