In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 21 | Yes |
Popular Name: 2-[4-[(5-bromo-3-pyridyl)sulfonyl]-1,4-diazepan-1-yl]acetamide 2-[4-[(5-bromo-3-pyridyl)sulfony…
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) | 0.03 | 0.64 | -48.95 | 3 | 7 | 1 | 98 | 378.272 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.03 | -1.31 | -13.51 | 2 | 7 | 0 | 97 | 377.264 | 4 | ↓ |