In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 17 | Yes |
Popular Name: 1-(azocan-1-yl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanone 1-(azocan-1-yl)-2-(1,3,4-thiadia…
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) | 2.52 | 5.98 | -9.8 | 0 | 4 | 0 | 46 | 271.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.