(E)-3-(5-phenylfuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Formula:C22H14N2OS Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(5-phenylfuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile is a drug-like molecule.

MolName	(E)-3-(5-phenylfuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
MolecularFormula	C22H14N2OS
Smiles	N#C/C(/c1nc(-c2ccccc2)cs1)=C\c1ccc(-c2ccccc2)o1
InChI	InChI=1S/C22H14N2OS/c23-14-18(22-24-20(15-26-22)16-7-3-1-4-8-16)13-19-11-12-21(25-19)17-9-5-2-6-10-17/h1-13,15H
InChIK	DVAFNWCBCUSITH-UHFFFAOYSA-N
TotalMolweight	354.432
Molweight	354.432
MonoisotopicMass	354.082683
CLogP	4.8518
CLogS	-5.897
H Acceptors	3
TotalSurfaceArea	283.35
Relative PSA	0.20822
PolarSurfaceArea	78.06
Druglikeness	-0.71337
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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