In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 33 | Yes |
Popular Name: [3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-(4-isobutylpiperazin-1-yl)methanone [3-(2,4-dimethoxyphenyl)-1-pheny…
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) | 3.28 | 11.91 | -51.61 | 1 | 7 | 1 | 61 | 449.575 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 10 | -13.68 | 0 | 7 | 0 | 60 | 448.567 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.