| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (2S)-1-[2-dimethylaminoethyl(propyl)amino]-3-(propylamino)propan-2-ol (2S)-1-[2-dimethylaminoethyl(pro…
| 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) | 0.92 | 5.32 | -192.87 | 5 | 4 | 3 | 46 | 248.435 | 11 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 3.37 | -40.2 | 3 | 4 | 1 | 47 | 246.419 | 11 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 5.85 | -103.97 | 4 | 4 | 2 | 49 | 247.427 | 11 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 3.16 | -87.98 | 4 | 4 | 2 | 45 | 247.427 | 11 | ↓ |
