In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 17 | Yes |
Popular Name: N-[[5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]-N-methyl-ethane-1,2-diamine N-[[5-(5-bromo-2-thienyl)-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) | 0.68 | 0.37 | -124.37 | 4 | 5 | 2 | 71 | 319.228 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.68 | -1.95 | -49.65 | 3 | 5 | 1 | 70 | 318.22 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.