| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 16 | Yes |
Popular Name: 1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone 1-[4-[[(2S)-tetrahydrofuran-2-yl…
| 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) | 0.24 | 5.84 | -36.8 | 1 | 4 | 1 | 34 | 227.328 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.24 | 3.9 | -8.97 | 0 | 4 | 0 | 33 | 226.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
