In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2011 | 21 | Yes |
Popular Name: (2R)-1-[(1-benzylimidazol-2-yl)methyl]-2-ethyl-piperidine (2R)-1-[(1-benzylimidazol-2-yl)m…
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) | 3.27 | 11.2 | -35.44 | 1 | 3 | 1 | 22 | 284.427 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 9.65 | -6.82 | 0 | 3 | 0 | 21 | 283.419 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 10.71 | -29.57 | 1 | 3 | 1 | 22 | 284.427 | 5 | ↓ |