In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 17 | Yes |
Popular Name: 1-[3-(benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]-N-methyl-methanamine 1-[3-(benzofuran-2-yl)-1,2,4-oxa…
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) | 2.05 | 3.29 | -47.83 | 2 | 5 | 1 | 69 | 230.247 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 1.85 | -9.61 | 1 | 5 | 0 | 64 | 229.239 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.