(E)-1-(5-chloro-2-hydroxyphenyl)-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one

Formula:C16H11O3ClF2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-(5-chloro-2-hydroxyphenyl)-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(5-chloro-2-hydroxyphenyl)-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
MolecularFormula	C16H11O3ClF2
Smiles	Oc(ccc(Cl)c1)c1C(/C=C/c(cc1)ccc1OC(F)F)=O
InChI	InChI=1S/C16H11ClF2O3/c17-11-4-8-15(21)13(9-11)14(20)7-3-10-1-5-12(6-2-10)22-16(18)19/h1-9,16,21H
InChIK	NBXOEKBAYKOFOL-UHFFFAOYSA-N
TotalMolweight	324.709
Molweight	324.709
MonoisotopicMass	324.036478
CLogP	3.7335
CLogS	-4.902
H Acceptors	3
H Donors	1
TotalSurfaceArea	234.24
Relative PSA	0.15429
PolarSurfaceArea	46.53
Druglikeness	-2.4634
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	3
StereoCon

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