| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 16 | Yes |
Popular Name: (2S)-1-(isopropylamino)-3-[methyl-[(1S)-1,2,2-trimethylpropyl]amino]propan-2-ol (2S)-1-(isopropylamino)-3-[methy…
| 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) | 2.19 | 4.34 | -96.8 | 4 | 3 | 2 | 41 | 232.412 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 4.87 | -37.84 | 3 | 3 | 1 | 44 | 231.404 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 3.07 | -31.21 | 3 | 3 | 1 | 37 | 231.404 | 7 | ↓ |
