| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2009 | 21 | No |
Popular Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-8-nitro-isoquinolin-5-amine N-[(4-methyl-1,2,4-triazol-3-yl)…
| 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) | 0.80 | 7.3 | -20.02 | 1 | 8 | 0 | 101 | 284.279 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
