| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2013 | 19 | Yes |
Popular Name: (1S)-1-(5-amino-1H-pyrazol-4-yl)-2-(4-methoxy-3,5-dimethyl-2-pyridyl)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) | 0.88 | 0.51 | -10.27 | 4 | 6 | 0 | 97 | 262.313 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 0.88 | -36.09 | 5 | 6 | 1 | 98 | 263.321 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 0.54 | -10.49 | 4 | 6 | 0 | 97 | 262.313 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 0.9 | -37.85 | 5 | 6 | 1 | 98 | 263.321 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 1.03 | -87.21 | 6 | 6 | 2 | 100 | 264.329 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.