7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-5-hydroxy-2-phenylchromen-4-one

Formula:C22H11N2O8F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-5-hydroxy-2-phenylchromen-4-one is a drug-like molecule.

MolName	7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-5-hydroxy-2-phenylchromen-4-one
MolecularFormula	C22H11N2O8F3
Smiles	[O-][N+](c1cc(C(F)(F)F)cc([N+]([O-])=O)c1Oc(cc1O)cc(OC(c2ccccc2)=C2)c1C2=O)=O
InChI	InChI=1S/C22H11F3N2O8/c23-22(24,25)12-6-14(26(30)31)21(15(7-12)27(32)33)34-13-8-16(28)20-17(29)10-18(35-19(20)9-13)11-4-2-1-3-5-11/h1-10,28H
InChIK	AHLYXCINYVTILA-UHFFFAOYSA-N
TotalMolweight	488.329
Molweight	488.329
MonoisotopicMass	488.046752
CLogP	3.4278
CLogS	-7.443
H Acceptors	10
H Donors	1
TotalSurfaceArea	324.89
Relative PSA	0.32928
PolarSurfaceArea	147.4
Druglikeness	-11.969
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.45714
Fragments	1
Non HAtoms	35
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	6
Symmetricatoms	9
AcidicOxygens	2
StereoCon

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