| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2009 | 20 | Yes |
Popular Name: (2S,3R)-1-[4-(4-chlorophenyl)piperazin-1-yl]-3-methyl-pentan-2-amine (2S,3R)-1-[4-(4-chlorophenyl)pip…
| 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) | 3.10 | 8.24 | -134.29 | 4 | 3 | 2 | 35 | 297.874 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.1 | -2.21 | 2 | 3 | 0 | 32 | 295.858 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 6.45 | -43.75 | 3 | 3 | 1 | 34 | 296.866 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 7.89 | -37.75 | 3 | 3 | 1 | 34 | 296.866 | 5 | ↓ |
