In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 31 | No |
Popular Name: N-[5-[(3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-phenyl-benzamide N-[5-[(3-nitrophenyl)methylsulfa…
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) | 5.59 | 13.31 | -19.98 | 1 | 7 | 0 | 101 | 448.529 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.66 | 11.65 | -52.25 | 0 | 7 | -1 | 107 | 447.521 | 7 | ↓ |