In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | Yes |
Popular Name: (1S,4R)-5-(1H-imidazol-4-ylsulfonyl)-5-azabicyclo[2.2.1]heptane (1S,4R)-5-(1H-imidazol-4-ylsulfo…
None
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) | 0.42 | 2.48 | -12.61 | 1 | 5 | 0 | 66 | 227.289 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.42 | 1.97 | -40.33 | 0 | 5 | -1 | 64 | 226.281 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.