| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 31st, 2006 | 22 | No |
Popular Name: 2-[4-oxo-5-[[2-(1,2,4-triazol-1-yl)phenyl]methylene]thiazol-2-yl]guanidine 2-[4-oxo-5-[[2-(1,2,4-triazol-1-…
| 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) | 0.05 | 7.28 | -40.38 | 3 | 8 | -1 | 125 | 312.338 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 7.27 | -48.79 | 3 | 8 | -1 | 123 | 312.338 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 7.58 | -41.25 | 3 | 8 | -1 | 123 | 312.338 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 7.55 | -18.64 | 4 | 8 | 0 | 125 | 313.346 | 3 | ↓ |
