| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 18 | Yes |
Popular Name: N3-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[(1S,8aR)-1,2,3,5,6,7,8,8a-oc…
| 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) | 1.04 | 4.54 | -40.84 | 4 | 5 | 1 | 60 | 250.37 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.04 | 4.66 | -81.51 | 5 | 5 | 2 | 62 | 251.378 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
