In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | Yes |
Popular Name: (3R)-1-[(1-ethylimidazol-2-yl)methyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1-ethylimidazol-2-yl)me…
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) | -0.38 | 7.44 | -46.84 | 1 | 6 | 0 | 80 | 251.286 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 6.48 | -45.95 | 0 | 6 | -1 | 78 | 250.278 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.