In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 20 | Yes |
Popular Name: 1-[2-[(3-chloro-2-pyridyl)sulfanyl]acetyl]piperidine-4-carboxylic 1-[2-[(3-chloro-2-pyridyl)sulfan…
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) | 1.64 | 6.42 | -52.61 | 0 | 5 | -1 | 73 | 313.786 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.