| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 15 | Yes |
Popular Name: (2S)-1-(ethylamino)-3-[isobutyl(isopropyl)amino]propan-2-ol (2S)-1-(ethylamino)-3-[isobutyl(…
| 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) | 1.30 | 4.56 | -98.37 | 4 | 3 | 2 | 41 | 218.385 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 3.3 | -30.28 | 3 | 3 | 1 | 37 | 217.377 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.30 | 5.16 | -35.3 | 3 | 3 | 1 | 44 | 217.377 | 8 | ↓ |
