| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 21 | Yes |
Popular Name: (R)-[(2R)-azepan-2-yl]-(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanol (R)-[(2R)-azepan-2-yl]-(9-chloro…
| 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) | 2.89 | 5.25 | -42.87 | 3 | 4 | 1 | 55 | 312.817 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 4.41 | -5.9 | 2 | 4 | 0 | 51 | 311.809 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
