| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 25 | Yes |
Popular Name: (2R,3S)-2-(2-chloro-4-methoxy-phenyl)-3-(2,6-dichloro-4-methoxy-phenyl)piperazine (2R,3S)-2-(2-chloro-4-methoxy-ph…
| 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) | 4.84 | 7.27 | -112.73 | 4 | 4 | 2 | 52 | 403.737 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 5.23 | -5.69 | 2 | 4 | 0 | 43 | 401.721 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 6.52 | -38.13 | 3 | 4 | 1 | 47 | 402.729 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 5.99 | -34.95 | 3 | 4 | 1 | 47 | 402.729 | 4 | ↓ |
