In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 23 | Yes |
Popular Name: N-[[(3R)-1-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]pyrrolidin-3-yl]methyl]methanesulfonamide N-[[(3R)-1-[2-(2-oxo-1,3-benzoxa…
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) | 0.94 | 4.59 | -60.68 | 2 | 7 | 1 | 86 | 340.425 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 2.22 | -20.35 | 1 | 7 | 0 | 85 | 339.417 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.