(2E)-2-benzylidene-5-chloro-1-benzofuran-3-one

Formula:C15H9O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (2E)-2-benzylidene-5-chloro-1-benzofuran-3-one is a drug-like molecule.

MolName	(2E)-2-benzylidene-5-chloro-1-benzofuran-3-one
MolecularFormula	C15H9O2Cl
Smiles	O=C1c(cc(cc2)Cl)c2O/C1=C/c1ccccc1
InChI	InChI=1S/C15H9ClO2/c16-11-6-7-13-12(9-11)15(17)14(18-13)8-10-4-2-1-3-5-10/h1-9H
InChIK	CPBANXAQQGJCHB-UHFFFAOYSA-N
TotalMolweight	256.687
Molweight	256.687
MonoisotopicMass	256.029107
CLogP	3.9246
CLogS	-4.878
H Acceptors	2
TotalSurfaceArea	187.4
Relative PSA	0.12295
PolarSurfaceArea	26.3
Druglikeness	0.12364
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	1
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

Click to Load Molecule: