(E)-3-(4-aminophenyl)-1-(furan-2-yl)prop-2-en-1-one

Formula:C13H11NO2 Mutagenic:low Tumorigenic:low Reproductive Effective:none (E)-3-(4-aminophenyl)-1-(furan-2-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(4-aminophenyl)-1-(furan-2-yl)prop-2-en-1-one
MolecularFormula	C13H11NO2
Smiles	Nc1ccc(/C=C/C(c2ccco2)=O)cc1
InChI	InChI=1S/C13H11NO2/c14-11-6-3-10(4-7-11)5-8-12(15)13-2-1-9-16-13/h1-9H,14H2
InChIK	ITPWUSUCOBCXRZ-UHFFFAOYSA-N
TotalMolweight	213.235
Molweight	213.235
MonoisotopicMass	213.078979
CLogP	1.8152
CLogS	-3.598
H Acceptors	3
H Donors	1
TotalSurfaceArea	175.48
Relative PSA	0.24174
PolarSurfaceArea	56.23
Druglikeness	0.82611
Mutagenic	low
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6875
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
Symmetricatoms	2
Amines	1
Aromatic Amines	1
StereoCon

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