| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 21 | Yes |
Popular Name: [4-(2-methoxyethyl)-1,4-diazepan-1-yl]-[(3S)-3-propylpyrrolidin-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) | 1.24 | 5.88 | -103.11 | 3 | 5 | 2 | 51 | 299.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 3.96 | -48.86 | 2 | 5 | 1 | 49 | 298.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
