| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 18 | No |
Popular Name: 4-[(1R)-1-(3-fluorophenyl)ethyl]-5-isopropyl-1,2,4-triazole-3-thiol 4-[(1R)-1-(3-fluorophenyl)ethyl]…
| 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) | 2.69 | 8.81 | -8.81 | 1 | 3 | 0 | 34 | 265.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 8.99 | -43.34 | 0 | 3 | -1 | 31 | 264.349 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
