| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 18 | No |
Popular Name: 5-isopropyl-4-[2-(methoxymethyl)phenyl]-1,2,4-triazole-3-thiol 5-isopropyl-4-[2-(methoxymethyl)…
| 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) | 1.98 | 8.66 | -10.72 | 1 | 4 | 0 | 43 | 263.366 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 8.59 | -48.77 | 0 | 4 | -1 | 40 | 262.358 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
