| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 19 | Yes |
Popular Name: 1-[4-fluoro-3-(1,2,4-triazol-1-ylmethyl)benzothiophen-2-yl]-N-methyl-methanamine 1-[4-fluoro-3-(1,2,4-triazol-1-y…
| 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) | 1.86 | 8.87 | -44.29 | 2 | 4 | 1 | 47 | 277.348 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 7.43 | -7.62 | 1 | 4 | 0 | 43 | 276.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
