| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | Yes |
Popular Name: 1-[[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]methyl]-N,N-dimethyl-cyclohexanamine 1-[[(3,5-dimethyl-1H-pyrazol-4-y…
| 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) | 2.26 | 6.72 | -118.56 | 4 | 4 | 2 | 50 | 266.433 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 4.75 | -40.97 | 3 | 4 | 1 | 49 | 265.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 5.37 | -34.27 | 3 | 4 | 1 | 45 | 265.425 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
