(E)-3-morpholin-4-yl-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]prop-2-en-1-one

Formula:C17H15N2O2F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-morpholin-4-yl-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-morpholin-4-yl-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]prop-2-en-1-one
MolecularFormula	C17H15N2O2F3S
Smiles	O=C(/C=C/N1CCOCC1)c1csc(-c2ccc(C(F)(F)F)cc2)n1
InChI	InChI=1S/C17H15F3N2O2S/c18-17(19,20)13-3-1-12(2-4-13)16-21-14(11-25-16)15(23)5-6-22-7-9-24-10-8-22/h1-6,11H,7-10H2
InChIK	YYPPCANTCSZQEZ-UHFFFAOYSA-N
TotalMolweight	368.378
Molweight	368.378
MonoisotopicMass	368.080632
CLogP	2.5587
CLogS	-3.113
H Acceptors	4
TotalSurfaceArea	263.27
Relative PSA	0.22
PolarSurfaceArea	70.67
Druglikeness	-2.6936
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	6
Symmetricatoms	6
Aromatic Nitrogens	1
StereoCon

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