2-(3,4-dimethoxyphenyl)-3-[2-(4-methoxyphenoxy)ethoxy]-6,8-dimethylchromen-4-one

Formula:C28H28O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(3,4-dimethoxyphenyl)-3-[2-(4-methoxyphenoxy)ethoxy]-6,8-dimethylchromen-4-one is not a drug-like molecule.

MolName2-(3,4-dimethoxyphenyl)-3-[2-(4-methoxyphenoxy)ethoxy]-6,8-dimethylchromen-4-one
MolecularFormulaC28H28O7
SmilesCc(cc1C)cc(C2=O)c1OC(c(cc1)cc(OC)c1OC)=C2OCCOc(cc1)ccc1OC
InChIInChI=1S/C28H28O7/c1-17-14-18(2)26-22(15-17)25(29)28(34-13-12-33-21-9-7-20(30-3)8-10-21)27(35-26)19-6-11-23(31-4)24(16-19)32-5/h6-11,14-16H,12-13H2,1-5H3
InChIKKULZSAZIJPBGNJ-UHFFFAOYSA-N
TotalMolweight476.523
Molweight476.523
MonoisotopicMass476.183505
CLogP5.2037
CLogS-5.795
H Acceptors7
TotalSurfaceArea368.77
Relative PSA0.19806
PolarSurfaceArea72.45
Druglikeness-7.2143
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Nasty Functions
Shape Index0.51429
Fragments1
Non HAtoms35
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms13
Symmetricatoms2
StereoCon

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