| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 17 | Yes |
Popular Name: 3-[(3S)-5-oxo-3-(pyrrolidin-1-ylmethyl)-3H-1,2,4-triazol-4-yl]propanoic 3-[(3S)-5-oxo-3-(pyrrolidin-1-yl…
| 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) | -1.07 | 5.62 | -62.35 | 2 | 7 | 0 | 95 | 240.263 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.07 | 3.19 | -44.55 | 1 | 7 | -1 | 94 | 239.255 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
