| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | Yes |
Popular Name: 1-[3-(azepan-1-ylmethyl)phenyl]-N-methyl-methanamine 1-[3-(azepan-1-ylmethyl)phenyl]-…
| 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) | 2.69 | 8.71 | -92.76 | 3 | 2 | 2 | 21 | 234.387 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 7.26 | -32.77 | 2 | 2 | 1 | 16 | 233.379 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
