In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2006 | 25 | Yes |
Popular Name: 3,4-difluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-benzenesulfonamide 3,4-difluoro-N-[4-(4-methylpiper…
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) | 2.95 | 6.67 | -45.49 | 2 | 5 | 1 | 54 | 368.429 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 4.45 | -40.61 | 0 | 5 | -1 | 55 | 366.413 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 4.38 | -9.46 | 1 | 5 | 0 | 53 | 367.421 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 6.8 | -61.79 | 1 | 5 | 0 | 56 | 367.421 | 4 | ↓ |