In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 25 | Yes |
Popular Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-methoxy-6-methyl-pyrimidin-2-yl)piperazin-1-yl]ethanone 2-(3,5-dimethylpyrazol-1-yl)-1-[…
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) | 1.32 | 7.41 | -17.12 | 0 | 8 | 0 | 76 | 344.419 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 7.69 | -45.68 | 1 | 8 | 1 | 78 | 345.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.