(5E)-2-amino-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one

Formula:C15H9N2O2F3S Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-2-amino-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one is a drug-like molecule.

MolName	(5E)-2-amino-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one
MolecularFormula	C15H9N2O2F3S
Smiles	NC(S/C1=C/c2ccc(-c3cc(C(F)(F)F)ccc3)o2)=NC1=O
InChI	InChI=1S/C15H9F3N2O2S/c16-15(17,18)9-3-1-2-8(6-9)11-5-4-10(22-11)7-12-13(21)20-14(19)23-12/h1-7H,(H2,19,20,21)
InChIK	REMMNCHRIXUIFQ-UHFFFAOYSA-N
TotalMolweight	338.308
Molweight	338.308
MonoisotopicMass	338.033682
CLogP	2.7852
CLogS	-5.527
H Acceptors	4
H Donors	1
TotalSurfaceArea	230.11
Relative PSA	0.31037
PolarSurfaceArea	93.89
Druglikeness	-3.93
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	2
BasicNitrogens	1
StereoCon

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