In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2011 | 18 | Yes |
Popular Name: (3R)-1-[(3R)-2,5-dioxopyrrolidin-3-yl]-3-ethyl-piperidine-3-carboxylic (3R)-1-[(3R)-2,5-dioxopyrrolidin…
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) | -0.33 | 1.26 | -56.57 | 1 | 6 | -1 | 97 | 253.278 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.51 | 1.74 | -52.81 | 1 | 6 | -1 | 90 | 253.278 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.33 | -0.82 | -100.25 | 0 | 6 | -2 | 96 | 252.27 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.