In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 18 | Yes |
Popular Name: (3S)-3-ethyl-1-[(2R,4S)-4-hydroxypyrrolidine-2-carbonyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[(2R,4S)-4-hydrox…
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) | -0.75 | 1.35 | -67.04 | 3 | 6 | 0 | 97 | 256.302 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.75 | -0.05 | -46.37 | 2 | 6 | -1 | 93 | 255.294 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.