| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2011 | 24 | Yes |
Popular Name: 7,7-dimethyl-N-[(1S,2R)-2-methylcyclohexyl]-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide 7,7-dimethyl-N-[(1S,2R)-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) | 3.03 | 7.27 | -18.18 | 2 | 5 | 0 | 79 | 330.428 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 6.57 | -56.34 | 1 | 5 | -1 | 82 | 329.42 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
