In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | Yes |
Popular Name: N-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-1,3,4-thiadiazol-2-amine N-[(1S,8aR)-1,2,3,5,6,7,8,8a-oct…
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) | 1.56 | 5.37 | -38.71 | 2 | 4 | 1 | 42 | 225.341 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 3.22 | -6.57 | 1 | 4 | 0 | 41 | 224.333 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.