In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 21 | Yes |
Popular Name: 2-[1-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl]triazol-4-yl]propan-2-amine 2-[1-[[5-(5-bromo-2-furyl)-1,3,4…
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) | 1.38 | -1.23 | -61.04 | 3 | 8 | 1 | 110 | 354.188 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | -1.49 | -14.96 | 2 | 8 | 0 | 109 | 353.18 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.