| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 22 | Yes |
Popular Name: 4-[[5-(dimethylamino)-1,3-dimethyl-pyrazol-4-yl]methylamino]-N-methyl-cyclohexanecarboxamide 4-[[5-(dimethylamino)-1,3-dimeth…
| 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) | 0.73 | 5.39 | -40.46 | 3 | 6 | 1 | 67 | 308.45 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.73 | 4.25 | -10.94 | 2 | 6 | 0 | 62 | 307.442 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.73 | 5.54 | -92.54 | 4 | 6 | 2 | 68 | 309.458 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
