| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 32 | Yes |
Popular Name: N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-4-(4-pyridyl)benzenesulfonamide N-[5-[(3S,5R)-3,5-dimethylpipera…
| 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) | 3.60 | 6.72 | -48.54 | 3 | 7 | 1 | 88 | 453.588 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 8.41 | -69.33 | 2 | 7 | 0 | 90 | 452.58 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 7.22 | -51.39 | 1 | 7 | -1 | 86 | 451.572 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.60 | 7.17 | -93.08 | 4 | 7 | 2 | 89 | 454.596 | 6 | ↓ |
