| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 20 | Yes |
Popular Name: (2R)-4-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-1-(2-methoxyethyl)-2-methyl-piperazine (2R)-4-[(5-chloro-1,3-dimethyl-p…
| 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) | 1.35 | 4.94 | -33.82 | 1 | 5 | 1 | 35 | 301.842 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.98 | -33.82 | 1 | 5 | 1 | 35 | 301.842 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 2.76 | -5.75 | 0 | 5 | 0 | 34 | 300.834 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
