In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2010 | 19 | Yes |
Popular Name: 2-bromo-N-[(6-methyl-3-pyridyl)methyl]benzenesulfonamide 2-bromo-N-[(6-methyl-3-pyridyl)m…
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) | 1.98 | 4.09 | -11.48 | 1 | 4 | 0 | 59 | 341.23 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 3.71 | -44.93 | 0 | 4 | -1 | 61 | 340.222 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 4.53 | -37.16 | 2 | 4 | 1 | 60 | 342.238 | 4 | ↓ |