| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 16 | Yes |
Popular Name: N-methyl-N-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methyl]ethane-1,2-diamine N-methyl-N-[[5-(2-thienyl)-1,2,4…
| 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) | 0.11 | -0.56 | -48.93 | 3 | 5 | 1 | 70 | 239.324 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.11 | 1.74 | -118.68 | 4 | 5 | 2 | 71 | 240.332 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
