In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 18 | Yes |
Popular Name: (1R)-1-[3-(benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]propan-1-amine (1R)-1-[3-(benzofuran-2-yl)-1,2,…
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) | 0.86 | 2.87 | -50.17 | 3 | 5 | 1 | 80 | 244.274 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 2.57 | -8.22 | 2 | 5 | 0 | 78 | 243.266 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.