In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | No |
Popular Name: 4-ethyl-1-[(3R)-1-methyl-2,5-dioxo-pyrrolidin-3-yl]piperidine-4-carboxylic 4-ethyl-1-[(3R)-1-methyl-2,5-dio…
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) | -0.27 | 5.94 | -66.31 | 1 | 6 | 0 | 82 | 268.313 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.27 | 3.76 | -51.39 | 0 | 6 | -1 | 81 | 267.305 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.