(Z)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-diphenylbut-2-ene-1,4-dione

Formula:C24H18O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-diphenylbut-2-ene-1,4-dione is a drug-like molecule.

MolName	(Z)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-diphenylbut-2-ene-1,4-dione
MolecularFormula	C24H18O4
Smiles	O=C(/C=C(\C(c1ccccc1)=O)/c1ccccc1)c(cc1)cc2c1OCCO2
InChI	InChI=1S/C24H18O4/c25-21(19-11-12-22-23(15-19)28-14-13-27-22)16-20(17-7-3-1-4-8-17)24(26)18-9-5-2-6-10-18/h1-12,15-16H,13-14H2
InChIK	XIVHZFXLBCCFQT-UHFFFAOYSA-N
TotalMolweight	370.403
Molweight	370.403
MonoisotopicMass	370.12051
CLogP	4.0566
CLogS	-5.067
H Acceptors	4
TotalSurfaceArea	287.01
Relative PSA	0.16055
PolarSurfaceArea	52.6
Druglikeness	-6.1153
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
StereoCon

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