| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 23 | Yes |
Popular Name: (4-fluoro-3-methyl-benzothiophen-2-yl)-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]methanone (4-fluoro-3-methyl-benzothiophen…
| 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) | 2.70 | 4.29 | -10.18 | 1 | 4 | 0 | 44 | 336.432 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.70 | 6.52 | -42.52 | 2 | 4 | 1 | 45 | 337.44 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
