| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (1S)-1-[4-(aminomethyl)phenyl]-2-[2-dimethylaminoethyl(propyl)amino]ethanol (1S)-1-[4-(aminomethyl)phenyl]-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) | 1.25 | 3.17 | -90.65 | 5 | 4 | 2 | 56 | 281.444 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 3.45 | -86.27 | 5 | 4 | 2 | 56 | 281.444 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 5.63 | -172.65 | 6 | 4 | 3 | 57 | 282.452 | 9 | ↓ |
