| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2011 | 21 | Yes |
Popular Name: 2-[4-(5-fluoro-2-methyl-benzoyl)-1,4-diazepan-1-yl]acetic 2-[4-(5-fluoro-2-methyl-benzoyl)…
| 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) | -0.06 | 8.9 | -32.87 | 1 | 5 | 0 | 65 | 294.326 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | 7.25 | -46.61 | 0 | 5 | -1 | 64 | 293.318 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
