| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 29 | Yes |
Popular Name: (3S)-6,8-dimethyl-3-[5-phenyl-3-[(3S)-pyrrolidin-3-yl]imidazol-4-yl]-3H-quinolin-2-one (3S)-6,8-dimethyl-3-[5-phenyl-3-…
| 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) | 3.38 | 10.92 | -93.97 | 3 | 5 | 2 | 65 | 386.499 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 9.5 | -35.08 | 2 | 5 | 1 | 61 | 385.491 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 10.75 | -186.11 | 4 | 5 | 3 | 67 | 387.507 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
