| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 30 | No |
Popular Name: 4-methyl-N-[3-(4-methylpiperazin-1-yl)-1,4-dioxo-2-naphthyl]benzenesulfonamide 4-methyl-N-[3-(4-methylpiperazin…
| 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) | 2.73 | 7.2 | -12.75 | 1 | 7 | 0 | 87 | 425.51 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 9.56 | -47.52 | 2 | 7 | 1 | 88 | 426.518 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 8.7 | -50.81 | 1 | 7 | 0 | 94 | 425.51 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 6.34 | -50.5 | 0 | 7 | -1 | 93 | 424.502 | 3 | ↓ |
