(E)-3-cyclopenta-1,3-dien-1-yl-1-(2-hydroxyphenyl)prop-2-en-1-one

Formula:C14H12O2 Mutagenic:high Tumorigenic:low Reproductive Effective:none (E)-3-cyclopenta-1,3-dien-1-yl-1-(2-hydroxyphenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-cyclopenta-1,3-dien-1-yl-1-(2-hydroxyphenyl)prop-2-en-1-one
MolecularFormula	C14H12O2
Smiles	Oc(cccc1)c1C(/C=C/C1=CC=CC1)=O
InChI	InChI=1S/C14H12O2/c15-13-8-4-3-7-12(13)14(16)10-9-11-5-1-2-6-11/h1-5,7-10,15H,6H2
InChIK	NGWZJJXWJHFVPK-UHFFFAOYSA-N
TotalMolweight	212.247
Molweight	212.247
MonoisotopicMass	212.08373
CLogP	2.4639
CLogS	-2.88
H Acceptors	2
H Donors	1
TotalSurfaceArea	175.33
Relative PSA	0.14909
PolarSurfaceArea	37.3
Druglikeness	-0.43117
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	16
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	2
StereoCon

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