In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[(6-oxo-1H-pyridin-3-yl)sulfonyl]-1,4-diazepan-1-yl]acetamide 2-[4-[(6-oxo-1H-pyridin-3-yl)sul…
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) | -1.26 | -1.1 | -55.21 | 4 | 8 | 1 | 118 | 315.375 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.26 | -2.87 | -18.13 | 3 | 8 | 0 | 117 | 314.367 | 4 | ↓ |