In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 19 | Yes |
Popular Name: 1-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl]azepane 1-[[5-(5-bromo-2-furyl)-1,3,4-ox…
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) | 2.65 | 3.61 | -39.85 | 1 | 5 | 1 | 57 | 327.202 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 1.31 | -6.34 | 0 | 5 | 0 | 55 | 326.194 | 3 | ↓ |