In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 28 | Yes |
Popular Name: (1R)-1-(2,5-dimethoxyphenyl)-2-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]ethanol (1R)-1-(2,5-dimethoxyphenyl)-2-[…
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) | 1.64 | 5.66 | -37.55 | 2 | 6 | 1 | 59 | 386.516 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 6.03 | -82.37 | 3 | 6 | 2 | 61 | 387.524 | 7 | ↓ |