| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2009 | 23 | Yes |
Popular Name: (4-ethylthiadiazol-5-yl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone (4-ethylthiadiazol-5-yl)-[4-[(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) | 2.41 | 5.45 | -7.61 | 0 | 5 | 0 | 49 | 334.42 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 7.59 | -47.89 | 1 | 5 | 1 | 51 | 335.428 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
