[3-(2-chlorophenoxy)-4-oxochromen-7-yl] 2,2-diphenylacetate

Formula:C29H19O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-(2-chlorophenoxy)-4-oxochromen-7-yl] 2,2-diphenylacetate is not a drug-like molecule.

MolName	[3-(2-chlorophenoxy)-4-oxochromen-7-yl] 2,2-diphenylacetate
MolecularFormula	C29H19O5Cl
Smiles	O=C(C(c1ccccc1)c1ccccc1)Oc(cc1)cc(OC=C2Oc(cccc3)c3Cl)c1C2=O
InChI	InChI=1S/C29H19ClO5/c30-23-13-7-8-14-24(23)35-26-18-33-25-17-21(15-16-22(25)28(26)31)34-29(32)27(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-18,27H
InChIK	CAUXRKHVGHKPKS-UHFFFAOYSA-N
TotalMolweight	482.918
Molweight	482.918
MonoisotopicMass	482.092102
CLogP	6.4169
CLogS	-7.366
H Acceptors	5
TotalSurfaceArea	357.17
Relative PSA	0.15701
PolarSurfaceArea	61.83
Druglikeness	-0.0675
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.51429
Fragments	1
Non HAtoms	35
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	4
Symmetricatoms	8
StereoCon

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