| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | Yes |
Popular Name: 1-[3,5-dimethyl-1-(8-quinolylmethyl)pyrazol-4-yl]-N-methyl-methanamine 1-[3,5-dimethyl-1-(8-quinolylmet…
| 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) | 1.87 | 7.5 | -45.82 | 2 | 4 | 1 | 47 | 281.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 6.05 | -11.34 | 1 | 4 | 0 | 43 | 280.375 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
