| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 16th, 2011 | 15 | Yes |
Popular Name: (4S)-4-(1,2,4-triazol-1-yl)-1,2,3,4-tetrahydroisoquinoline (4S)-4-(1,2,4-triazol-1-yl)-1,2,…
| 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) | 0.41 | 5.33 | -7.2 | 1 | 4 | 0 | 43 | 200.245 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.41 | 6.33 | -49.61 | 2 | 4 | 1 | 47 | 201.253 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
