| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 19 | Yes |
Popular Name: (2R)-2-amino-1-[(2S)-2-(dihydroxymethylene)pyrrolidin-1-yl]-3-phenyl-propan-1-one (2R)-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) | -0.19 | 2.2 | -12.42 | 4 | 5 | 0 | 87 | 262.309 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 6.63 | -145.91 | 2 | 5 | -2 | 92 | 260.293 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 2.51 | -44.25 | 5 | 5 | 1 | 88 | 263.317 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
