(E)-1-(2-aminophenyl)-3-thiophen-2-ylprop-2-en-1-one

Formula:C13H11NOS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-(2-aminophenyl)-3-thiophen-2-ylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(2-aminophenyl)-3-thiophen-2-ylprop-2-en-1-one
MolecularFormula	C13H11NOS
Smiles	Nc(cccc1)c1C(/C=C/c1cccs1)=O
InChI	InChI=1S/C13H11NOS/c14-12-6-2-1-5-11(12)13(15)8-7-10-4-3-9-16-10/h1-9H,14H2
InChIK	XQWOGFAJTPHZCA-UHFFFAOYSA-N
TotalMolweight	229.302
Molweight	229.302
MonoisotopicMass	229.056134
CLogP	2.4931
CLogS	-3.926
H Acceptors	2
H Donors	1
TotalSurfaceArea	181.73
Relative PSA	0.26781
PolarSurfaceArea	71.33
Druglikeness	2.5545
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	16
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Amines	1
Aromatic Amines	1
StereoCon

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