In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 20 | Yes |
Popular Name: 2,4-dibromo-N-[2-(1-piperidyl)ethyl]benzenesulfonamide 2,4-dibromo-N-[2-(1-piperidyl)et…
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) | 3.49 | 6.03 | -42.31 | 2 | 4 | 1 | 51 | 427.182 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.49 | 3.81 | -6.57 | 1 | 4 | 0 | 49 | 426.174 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.49 | 5.68 | -31.59 | 1 | 4 | 0 | 53 | 426.174 | 5 | ↓ |