| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 23 | No |
Popular Name: (3R)-3-[4-(7-methyloctoxy)phenyl]pyrrolidine-2,5-quinone (3R)-3-[4-(7-methyloctoxy)phenyl…
| 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) | 4.43 | 8.24 | -9.98 | 1 | 4 | 0 | 55 | 317.429 | 9 | ↓ |
| Ref Reference (pH 7) | 4.43 | 8.25 | -9.99 | 1 | 4 | 0 | 55 | 317.429 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.62 | 5.71 | -42.96 | 0 | 4 | -1 | 62 | 316.421 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.62 | 5.71 | -42.98 | 0 | 4 | -1 | 62 | 316.421 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.62 | 5.71 | -42.71 | 0 | 4 | -1 | 62 | 316.421 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.62 | 5.71 | -42.7 | 0 | 4 | -1 | 62 | 316.421 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
