| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: 1-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]isoquinoline-3-carboxylic 1-[(5-methyl-4H-1,2,4-triazol-3-…
| 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) | 2.36 | 7.4 | -61.37 | 1 | 6 | -1 | 95 | 285.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
