| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 21 | Yes |
Popular Name: 4-[[5-(dimethylamino)-3-isopropyl-1-methyl-pyrazol-4-yl]methylamino]cyclohexanol 4-[[5-(dimethylamino)-3-isopropy…
| 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) | 1.66 | 5.48 | -38.47 | 3 | 5 | 1 | 58 | 295.451 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 4.25 | -5.73 | 2 | 5 | 0 | 53 | 294.443 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 5.64 | -92.08 | 4 | 5 | 2 | 59 | 296.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
