| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 19 | Yes |
Popular Name: 4-(1-butylpyrazol-4-yl)-1-but-2-ynyl-3,6-dihydro-2H-pyridine 4-(1-butylpyrazol-4-yl)-1-but-2-…
| 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) | 3.12 | 8.34 | -7.11 | 0 | 3 | 0 | 21 | 257.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 10.64 | -39.39 | 1 | 3 | 1 | 22 | 258.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
