| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2011 | 26 | Yes |
Popular Name: (2-chloro-4-fluoro-phenyl)-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methanone (2-chloro-4-fluoro-phenyl)-[4-[(…
| 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) | 3.29 | 10.9 | -46.01 | 1 | 4 | 1 | 34 | 377.867 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 9.06 | -10.95 | 0 | 4 | 0 | 33 | 376.859 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
