| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 19 | Yes |
Popular Name: (7R)-1-[(3,4-dimethoxyphenyl)methyl]-7-methyl-1,4-diazepane (7R)-1-[(3,4-dimethoxyphenyl)met…
| 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) | 1.28 | 4.72 | -35.8 | 2 | 4 | 1 | 35 | 265.377 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 5.99 | -118.02 | 3 | 4 | 2 | 40 | 266.385 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 3.96 | -41.46 | 2 | 4 | 1 | 38 | 265.377 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
