| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: 2-[[(1S,2S)-2-amino-1-(4-fluorophenyl)propyl]-cyclohexyl-amino]ethanol 2-[[(1S,2S)-2-amino-1-(4-fluorop…
| 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) | 2.57 | 5.03 | -114.45 | 5 | 3 | 2 | 52 | 296.43 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.57 | 4.13 | -30.73 | 4 | 3 | 1 | 51 | 295.422 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 3.47 | -45.01 | 4 | 3 | 1 | 51 | 295.422 | 6 | ↓ |
