In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | Yes |
Popular Name: 4-ethyl-1-[(2R)-piperidine-2-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(2R)-piperidine-2-car…
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) | 0.94 | 5.84 | -64.41 | 2 | 5 | 0 | 77 | 268.357 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 4.59 | -46.87 | 1 | 5 | -1 | 72 | 267.349 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.