| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 15 | Yes |
Popular Name: [(2S)-2-methylazepan-1-yl]-[(2R)-pyrrolidin-2-yl]methanone [(2S)-2-methylazepan-1-yl]-[(2R)…
| 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) | 1.58 | 5.05 | -35.3 | 2 | 3 | 1 | 37 | 211.329 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.73 | -5.27 | 1 | 3 | 0 | 32 | 210.321 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
