In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 32 | Yes |
Popular Name: N-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide N-[5-[(3-chlorophenyl)methylsulf…
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) | 5.27 | 11.64 | -16.05 | 1 | 7 | 0 | 83 | 494.038 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.34 | 9.94 | -46.39 | 0 | 7 | -1 | 89 | 493.03 | 11 | ↓ |