| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 15 | Yes |
Popular Name: (3R)-3-(1H-1,2,4-triazol-3-yl)-1,2,3,4-tetrahydroisoquinoline (3R)-3-(1H-1,2,4-triazol-3-yl)-1…
None
| 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) | 0.63 | 3.9 | -8.08 | 2 | 4 | 0 | 54 | 200.245 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.63 | 5.16 | -37.88 | 3 | 4 | 1 | 58 | 201.253 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
