In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | Yes |
Popular Name: 2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-propyl-thiazole-5-carboxylic 2-[(1S,4R)-5-azabicyclo[2.2.1]he…
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) | 3.09 | 8.67 | -53.85 | 0 | 4 | -1 | 56 | 265.358 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 9.07 | -37.58 | 1 | 4 | 0 | 58 | 266.366 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.