| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 18 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]propan-2-ol (2S)-1-(diethylamino)-3-[[(1S)-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) | 1.35 | 6.48 | -98.88 | 4 | 4 | 2 | 49 | 261.454 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 4 | -95.97 | 4 | 4 | 2 | 45 | 261.454 | 11 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 5.94 | -189.84 | 5 | 4 | 3 | 46 | 262.462 | 11 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.75 | -80.06 | 4 | 4 | 2 | 41 | 261.454 | 11 | ↓ |
