| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 18 | No |
Popular Name: 4-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5-propyl-1,2,4-triazole-3-thiol 4-[(1S)-1-(2,4-dimethylthiazol-5…
| 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) | 2.40 | 8.21 | -42.3 | 0 | 4 | -1 | 44 | 281.43 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 8.38 | -12.87 | 1 | 4 | 0 | 47 | 282.438 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
