In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | No |
Popular Name: 4-ethyl-1-[(4R)-thiazolidine-4-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(4R)-thiazolidine-4-c…
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) | 0.41 | 3.82 | -48.96 | 1 | 5 | -1 | 72 | 271.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 4.89 | -67.47 | 2 | 5 | 0 | 77 | 272.37 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.