| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 19 | Yes |
Popular Name: [4-fluoro-3-[(4-methylpyrazol-1-yl)methyl]benzothiophen-2-yl]methanamine [4-fluoro-3-[(4-methylpyrazol-1-…
| 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) | 2.79 | 6.17 | -52.9 | 3 | 3 | 1 | 45 | 276.36 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 5.79 | -9.26 | 2 | 3 | 0 | 44 | 275.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
