| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (3S)-1-[2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl]-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-[2-[(5-bromo-2-pyridyl)am…
| 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) | 1.92 | 7.86 | -55.75 | 2 | 6 | 0 | 87 | 356.22 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 7.02 | -56.88 | 1 | 6 | -1 | 93 | 355.212 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
