In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: [5-(benzofuran-3-yl)-1,3,4-oxadiazol-2-yl]methanamine [5-(benzofuran-3-yl)-1,3,4-oxadi…
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) | 0.80 | -1.15 | -54.05 | 3 | 5 | 1 | 80 | 216.22 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.80 | -1.55 | -11.52 | 2 | 5 | 0 | 78 | 215.212 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.