In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 26 | Yes |
Popular Name: 6-[4-(6-hydroxy-4,4-dimethyl-6-oxo-hexyl)phenyl]-3,3-dimethyl-hexanoic 6-[4-(6-hydroxy-4,4-dimethyl-6-o…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 5.22 | 14.71 | -93.84 | 0 | 4 | -2 | 80 | 360.494 | 12 | ↓ |
Lo Low (pH 4.5-6) | 5.22 | 12.73 | -48.51 | 1 | 4 | -1 | 77 | 361.502 | 12 | ↓ |