| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 19 | Yes |
Popular Name: [4-(2-methoxyethyl)-1,4-diazepan-1-yl]-[(3S)-3-methylpyrrolidin-3-yl]methanone [4-(2-methoxyethyl)-1,4-diazepan…
| 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) | 0.34 | 4.76 | -85.89 | 3 | 5 | 2 | 51 | 271.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 2.78 | -42.82 | 2 | 5 | 1 | 49 | 270.397 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
