In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2010 | 14 | Yes |
Popular Name: [(3R)-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidin-3-yl]methanamine [(3R)-1-[(3-methyl-1,2,4-oxadiaz…
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) | -0.87 | 1.11 | -112.67 | 4 | 5 | 2 | 71 | 198.27 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.87 | -1.42 | -52.06 | 3 | 5 | 1 | 70 | 197.262 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.