In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 15 | Yes |
Popular Name: [(2R)-1-[2-(2-methylimidazol-1-yl)ethyl]pyrrolidin-2-yl]methanamine [(2R)-1-[2-(2-methylimidazol-1-y…
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) | -0.69 | 3.87 | -88.66 | 4 | 4 | 2 | 50 | 210.325 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.69 | 3.39 | -48.96 | 3 | 4 | 1 | 49 | 209.317 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.69 | 5.66 | -198.34 | 5 | 4 | 3 | 51 | 211.333 | 4 | ↓ |