In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: 2-[(1R,4S,5R)-7-oxabicyclo[2.2.1]heptan-5-yl]-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine 2-[(1R,4S,5R)-7-oxabicyclo[2.2.1…
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) | 1.14 | 3.76 | -44.63 | 2 | 3 | 1 | 39 | 237.348 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 2.36 | -5.78 | 1 | 3 | 0 | 34 | 236.34 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.