| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 18 | Yes |
Popular Name: 1-[[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]methyl]-N,N-dimethyl-cyclopentanamine 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) | 1.75 | 4.96 | -33.72 | 3 | 4 | 1 | 45 | 251.398 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 4.14 | -41.61 | 3 | 4 | 1 | 49 | 251.398 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 6.24 | -118.49 | 4 | 4 | 2 | 50 | 252.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
