| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 27 | Yes |
Popular Name: 4-methyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-N-(p-tolyl)benzenesulfonamide 4-methyl-3-(4-methylpiperazin-4-…
| 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) | 2.39 | 7.45 | -45.55 | 2 | 6 | 1 | 71 | 388.513 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 5.14 | -46.36 | 0 | 6 | -1 | 72 | 386.497 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 7.5 | -64.03 | 1 | 6 | 0 | 73 | 387.505 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 5.1 | -11.17 | 1 | 6 | 0 | 70 | 387.505 | 4 | ↓ |
