| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | Yes |
Popular Name: (1S)-2-(2-amino-4-pyridyl)-1-[(1S)-cyclohex-3-en-1-yl]ethanol (1S)-2-(2-amino-4-pyridyl)-1-[(1…
| 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) | 1.81 | 4.03 | -31 | 4 | 3 | 1 | 60 | 219.308 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 3.56 | -6.39 | 3 | 3 | 0 | 59 | 218.3 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
