(E)-3-(furan-2-yl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide

Formula:C18H13N2O2F3S Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-(furan-2-yl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide
MolecularFormula	C18H13N2O2F3S
Smiles	O=C(/C=C/c1ccco1)Nc1ncc(Cc2cc(C(F)(F)F)ccc2)s1
InChI	InChI=1S/C18H13F3N2O2S/c19-18(20,21)13-4-1-3-12(9-13)10-15-11-22-17(26-15)23-16(24)7-6-14-5-2-8-25-14/h1-9,11H,10H2,(H,22,23,24)
InChIK	JQHPATIDMZKJBA-UHFFFAOYSA-N
TotalMolweight	378.373
Molweight	378.373
MonoisotopicMass	378.064982
CLogP	4.6967
CLogS	-5.512
H Acceptors	4
H Donors	1
TotalSurfaceArea	276.1
Relative PSA	0.25331
PolarSurfaceArea	83.37
Druglikeness	-5.9394
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! thiazol-2-ylamine
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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