In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1R,2R)-2-(2-methylimidazol-1-yl)-N-propyl-cyclooctanamine (1R,2R)-2-(2-methylimidazol-1-yl…
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) | 3.14 | 9.32 | -96.04 | 3 | 3 | 2 | 36 | 251.418 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.14 | 8.85 | -37.58 | 2 | 3 | 1 | 34 | 250.41 | 4 | ↓ |