| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 15 | No |
Popular Name: 4-(C-methyl-N-(1,2,4-triazol-4-yl)carbonimidoyl)phenol 4-(C-methyl-N-(1,2,4-triazol-4-y…
| 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) | 0.86 | 4.74 | -12.52 | 1 | 5 | 0 | 63 | 202.217 | 2 | ↓ |
| Ref Reference (pH 7) | 0.86 | 5.04 | -11.78 | 1 | 5 | 0 | 63 | 202.217 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 5.86 | -42.56 | 0 | 5 | -1 | 66 | 201.209 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
