In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2011 | 21 | Yes |
Popular Name: (3R)-1-[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[2-[cyclohexyl(methyl)ami…
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) | 1.86 | 9.34 | -45.68 | 1 | 5 | 0 | 65 | 296.411 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 7.53 | -48.06 | 0 | 5 | -1 | 64 | 295.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.