| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 14 | Yes |
Popular Name: (2S)-2-amino-2-[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]ethanol (2S)-2-amino-2-[5-(2-thienyl)-1H…
| 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 | -1.24 | -37.98 | 5 | 5 | 1 | 89 | 211.27 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.75 | -1.57 | -8.62 | 4 | 5 | 0 | 88 | 210.262 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.75 | -1.38 | -35.49 | 4 | 5 | 0 | 88 | 210.262 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
