(E)-2-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enenitrile

Formula:C22H14N2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enenitrile is not a drug-like molecule.

MolName	(E)-2-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enenitrile
MolecularFormula	C22H14N2S2
Smiles	N#C/C(/c1nc(-c(cc2)ccc2-c2ccccc2)cs1)=C\c1cccs1
InChI	InChI=1S/C22H14N2S2/c23-14-19(13-20-7-4-12-25-20)22-24-21(15-26-22)18-10-8-17(9-11-18)16-5-2-1-3-6-16/h1-13,15H
InChIK	NGSJCHSMFZXPPX-UHFFFAOYSA-N
TotalMolweight	370.499
Molweight	370.499
MonoisotopicMass	370.059838
CLogP	5.4387
CLogS	-6.533
H Acceptors	2
TotalSurfaceArea	289.6
Relative PSA	0.22531
PolarSurfaceArea	93.16
Druglikeness	-1.0675
Mutagenic	none
Tumorigenic	none
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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