| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 22 | Yes |
Popular Name: (2R,3R,4S)-1-[(4-chloro-2-methyl-8-quinolyl)methyl]-2-(hydroxymethyl)pyrrolidine-3,4-diol (2R,3R,4S)-1-[(4-chloro-2-methyl…
| 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) | 0.97 | 1.08 | -31.34 | 4 | 5 | 1 | 78 | 323.8 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | -0.68 | -8.58 | 3 | 5 | 0 | 77 | 322.792 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
