| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | No |
Popular Name: (2S)-2-amino-4-methylsulfonyl-1-[(2S)-2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]butan-1-one (2S)-2-amino-4-methylsulfonyl-1-…
| 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) | -0.66 | 0.82 | -65.32 | 4 | 6 | 1 | 98 | 300.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.66 | 0.5 | -20.62 | 3 | 6 | 0 | 96 | 299.396 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
