| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2013 | 17 | Yes |
Popular Name: (1S)-1-(5-amino-1H-pyrazol-4-yl)-2-(2-bromo-4-fluoro-phenyl)ethanol (1S)-1-(5-amino-1H-pyrazol-4-yl)…
| 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) | 1.75 | 2.39 | -7.68 | 4 | 4 | 0 | 75 | 300.131 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 2.41 | -9.94 | 4 | 4 | 0 | 75 | 300.131 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 2.55 | -38.67 | 5 | 4 | 1 | 76 | 301.139 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.