| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 16 | No |
Popular Name: (2S)-2-amino-1-[(2S)-2-(dihydroxymethylene)pyrrolidin-1-yl]-4-methylsulfanyl-butan-1-one (2S)-2-amino-1-[(2S)-2-(dihydrox…
| 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) | -1.20 | 5.07 | -130.71 | 3 | 5 | -1 | 94 | 245.324 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.20 | 4.75 | -144.67 | 2 | 5 | -2 | 92 | 244.316 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
