| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | No |
Popular Name: 5-(4-tert-butylpiperazin-1-yl)-4-isopropyl-1,2,4-triazole-3-thiol 5-(4-tert-butylpiperazin-1-yl)-4…
| 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) | 1.69 | 9.89 | -49.32 | 2 | 5 | 1 | 41 | 284.453 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 7.82 | -8.39 | 1 | 5 | 0 | 40 | 283.445 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
