| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: (5S)-8-bromo-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine (5S)-8-bromo-N-[(1S)-2-imidazol-…
| 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) | 1.99 | 9.66 | -41.05 | 2 | 4 | 1 | 44 | 351.268 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.99 | 10.17 | -103.25 | 3 | 4 | 2 | 45 | 352.276 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
