| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2009 | 26 | Yes |
Popular Name: (2S,3R)-2,3-bis(2-chloro-4-methoxy-phenyl)-1-ethyl-piperazine (2S,3R)-2,3-bis(2-chloro-4-metho…
| 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) | 4.85 | 9.03 | -112.02 | 3 | 4 | 2 | 40 | 397.346 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.85 | 7.46 | -5.39 | 1 | 4 | 0 | 34 | 395.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.85 | 8.79 | -40.46 | 2 | 4 | 1 | 38 | 396.338 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.85 | 7.69 | -32.67 | 2 | 4 | 1 | 35 | 396.338 | 5 | ↓ |
