In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 29 | No |
Popular Name: 2-[(oxoBLAHyl)methylsulfanyl]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide 2-[(oxoBLAHyl)methylsulfanyl]-N-…
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) | 3.38 | 9.46 | -30.62 | 2 | 7 | 0 | 101 | 449.627 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 8.26 | -54.51 | 1 | 7 | -1 | 107 | 448.619 | 9 | ↓ |