In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 20 | No |
Popular Name: 1-[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]-5-phenyl-imidazole-2-thiol 1-[(1R,8R)-2,3,5,6,7,8-hexahydro…
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) | 2.19 | 9.66 | -40.94 | 2 | 3 | 1 | 25 | 286.424 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 7.24 | -12.16 | 1 | 3 | 0 | 24 | 285.416 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.