In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 15 | No |
Popular Name: 1-[(1R,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]tetrazole-5-thiol 1-[(1R,8aS)-1,2,3,5,6,7,8,8a-oct…
None
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) | 1.08 | 5.51 | -46.95 | 1 | 5 | 0 | 48 | 225.321 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 3.36 | -35.62 | 0 | 5 | -1 | 47 | 224.313 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.