| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 16 | Yes |
Popular Name: 4-isopropyl-3-[(2R,4S)-4-methoxypyrrolidin-2-yl]-5-methyl-1,2,4-triazole 4-isopropyl-3-[(2R,4S)-4-methoxy…
| 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) | 0.24 | 4.11 | -39.28 | 2 | 5 | 1 | 57 | 225.316 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 2.71 | -9.45 | 1 | 5 | 0 | 52 | 224.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
