In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 17 | Yes |
Popular Name: 2-[[(1S)-2-amino-1-(2-methoxyphenyl)ethyl]-ethyl-amino]ethanol 2-[[(1S)-2-amino-1-(2-methoxyphe…
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) | 0.48 | 1.45 | -111.83 | 5 | 4 | 2 | 62 | 240.347 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.48 | -0.71 | -38.95 | 4 | 4 | 1 | 60 | 239.339 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 1.34 | -25.88 | 4 | 4 | 1 | 60 | 239.339 | 7 | ↓ |