| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 21 | Yes |
Popular Name: (2S,4S)-4-[[1-(1-ethylpropyl)pyrazol-3-yl]methyl]-2-isopropyl-tetrahydropyran-4-ol (2S,4S)-4-[[1-(1-ethylpropyl)pyr…
| 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) | 3.47 | 6.75 | -5.26 | 1 | 4 | 0 | 47 | 294.439 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.47 | 6.39 | -31.73 | 2 | 4 | 1 | 49 | 295.447 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
