| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 21 | Yes |
Popular Name: (2R,3R,4S)-1-[(2-chloro-8-quinolyl)methyl]-2-(hydroxymethyl)pyrrolidine-3,4-diol (2R,3R,4S)-1-[(2-chloro-8-quinol…
| 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) | 0.64 | 0.47 | -29.19 | 4 | 5 | 1 | 78 | 309.773 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | -1.28 | -10.17 | 3 | 5 | 0 | 77 | 308.765 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
