| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 14 | Yes |
Popular Name: 3-[(2S,4S)-4-methoxypyrrolidin-2-yl]-4,5-dimethyl-1,2,4-triazole 3-[(2S,4S)-4-methoxypyrrolidin-2…
| 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) | -0.50 | 3.05 | -45.18 | 2 | 5 | 1 | 57 | 197.262 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 1.78 | -16.03 | 1 | 5 | 0 | 52 | 196.254 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
