In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 30 | Yes |
Popular Name: (2S)-1-(benzyl-methyl-amino)-3-[4-[[2-(4-pyridyl)ethylamino]methyl]phenoxy]propan-2-ol (2S)-1-(benzyl-methyl-amino)-3-[…
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) | 2.85 | 8.95 | -41.4 | 3 | 5 | 1 | 59 | 406.55 | 12 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 9.39 | -78.62 | 4 | 5 | 2 | 60 | 407.558 | 12 | ↓ |