7-[(2-chloro-6-fluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one

Formula:C22H14O4ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none 7-[(2-chloro-6-fluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one is not a drug-like molecule.

MolName7-[(2-chloro-6-fluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
MolecularFormulaC22H14O4ClF
SmilesOc1cc(OCc(c(F)ccc2)c2Cl)cc(OC(c2ccccc2)=C2)c1C2=O
InChIInChI=1S/C22H14ClFO4/c23-16-7-4-8-17(24)15(16)12-27-14-9-18(25)22-19(26)11-20(28-21(22)10-14)13-5-2-1-3-6-13/h1-11,25H,12H2
InChIKYTUYDLDLDVQIME-UHFFFAOYSA-N
TotalMolweight396.8
Molweight396.8
MonoisotopicMass396.056465
CLogP5.082
CLogS-5.839
H Acceptors4
H Donors1
TotalSurfaceArea283.62
Relative PSA0.16268
PolarSurfaceArea55.76
Druglikeness-1.1304
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.53571
Fragments1
Non HAtoms28
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms4
Symmetricatoms2
StereoCon

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