(E)-3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one

Formula:C15H12O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
MolecularFormula	C15H12O4
Smiles	Oc(cccc1)c1C(/C=C/c(cc1)cc(O)c1O)=O
InChI	InChI=1S/C15H12O4/c16-12-4-2-1-3-11(12)13(17)7-5-10-6-8-14(18)15(19)9-10/h1-9,16,18-19H
InChIK	PSYVAIWGYVDYHN-UHFFFAOYSA-N
TotalMolweight	256.256
Molweight	256.256
MonoisotopicMass	256.07356
CLogP	2.2667
CLogS	-2.952
H Acceptors	4
H Donors	3
TotalSurfaceArea	196.32
Relative PSA	0.26661
PolarSurfaceArea	77.76
Druglikeness	0.13358
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
StereoCon

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