In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 17 | Yes |
Popular Name: 1-[3,5-dimethyl-1-(2-pyrazol-1-ylethyl)pyrazol-4-yl]-N-methyl-methanamine 1-[3,5-dimethyl-1-(2-pyrazol-1-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) | 0.39 | 4.99 | -48.46 | 2 | 5 | 1 | 52 | 234.327 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 3.54 | -9.06 | 1 | 5 | 0 | 48 | 233.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.