In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2009 | 31 | Yes |
Popular Name: (2S)-1-(benzyl-methyl-amino)-3-[4-[[(2-methoxyphenyl)methylamino]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) | 3.74 | 10.79 | -87.37 | 4 | 5 | 2 | 60 | 422.569 | 12 | ↓ |
Hi High (pH 8-9.5) | 3.74 | 9.31 | -40.1 | 3 | 5 | 1 | 55 | 421.561 | 12 | ↓ |