| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: (2R)-1-[2-dimethylaminoethyl(propyl)amino]-3-(ethylamino)propan-2-ol (2R)-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) | 0.42 | 4.28 | -185.58 | 5 | 4 | 3 | 46 | 234.408 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 4.83 | -102.89 | 4 | 4 | 2 | 49 | 233.4 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 2.34 | -39.25 | 3 | 4 | 1 | 47 | 232.392 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 0.12 | -29.66 | 2 | 4 | 0 | 46 | 231.384 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 0.43 | -33.57 | 3 | 4 | 1 | 40 | 232.392 | 10 | ↓ |
| Mid Mid (pH 6-8) | 0.42 | 2.05 | -83.14 | 4 | 4 | 2 | 45 | 233.4 | 10 | ↓ |
