In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 20 | Yes |
Popular Name: (2S,3R)-1-isopentyl-6-oxo-2-(2-thienyl)piperidine-3-carboxylic (2S,3R)-1-isopentyl-6-oxo-2-(2-t…
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) | 2.82 | 8.95 | -40.32 | 0 | 4 | -1 | 60 | 294.396 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.