prop-2-ynyl (E)-3-(5-thiophen-2-ylthiophen-2-yl)prop-2-enoate

Formula:C14H10O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none prop-2-ynyl (E)-3-(5-thiophen-2-ylthiophen-2-yl)prop-2-enoate is a drug-like molecule.

MolName	prop-2-ynyl (E)-3-(5-thiophen-2-ylthiophen-2-yl)prop-2-enoate
MolecularFormula	C14H10O2S2
Smiles	C#CCOC(/C=C/c1ccc(-c2cccs2)s1)=O
InChI	InChI=1S/C14H10O2S2/c1-2-9-16-14(15)8-6-11-5-7-13(18-11)12-4-3-10-17-12/h1,3-8,10H,9H2
InChIK	GXMQTMIPRWXCET-UHFFFAOYSA-N
TotalMolweight	274.363
Molweight	274.363
MonoisotopicMass	274.01222
CLogP	3.7174
CLogS	-4.789
H Acceptors	2
TotalSurfaceArea	216.72
Relative PSA	0.2942
PolarSurfaceArea	82.78
Druglikeness	-0.44186
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.72222
Fragments	1
Non HAtoms	18
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	2
StereoCon

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