| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 20 | Yes |
Popular Name: 3-(ethylamino)-1-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]propan-1-one 3-(ethylamino)-1-[4-[[(2R)-tetra…
| 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) | 0.28 | 6.72 | -90.54 | 3 | 5 | 2 | 51 | 285.432 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 4.84 | -44.69 | 2 | 5 | 1 | 49 | 284.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
