| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 16 | No |
Popular Name: 4-[(4-methylthiazol-2-yl)methyl]-5-propyl-1,2,4-triazole-3-thiol 4-[(4-methylthiazol-2-yl)methyl]…
| 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) | 1.82 | 7.1 | -51.92 | 0 | 4 | -1 | 44 | 253.376 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.09 | 7.2 | -15.9 | 1 | 4 | 0 | 47 | 254.384 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
