| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | Yes |
Popular Name: [(3S)-3-ethylpyrrolidin-3-yl]-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]methanone [(3S)-3-ethylpyrrolidin-3-yl]-[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) | 0.68 | 5.12 | -102.55 | 3 | 5 | 2 | 51 | 285.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 3.2 | -48.56 | 2 | 5 | 1 | 49 | 284.424 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
