In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | Yes |
Popular Name: 4-ethyl-1-[(2S)-morpholine-2-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(2S)-morpholine-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) | -0.47 | 4.46 | -87.24 | 2 | 6 | 0 | 86 | 270.329 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.47 | 3.11 | -51.56 | 1 | 6 | -1 | 82 | 269.321 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.