In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 17 | Yes |
Popular Name: (2R,4R)-1-(5-bromo-2-pyridyl)-4-methoxy-pyrrolidine-2-carboxylic (2R,4R)-1-(5-bromo-2-pyridyl)-4-…
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) | 0.00 | 4.03 | -55.72 | 0 | 5 | -1 | 65 | 300.132 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.00 | 4.29 | -39.5 | 1 | 5 | 0 | 67 | 301.14 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.