In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 29 | Yes |
Popular Name: 4-butoxy-N-[5-[(E)-cinnamyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide 4-butoxy-N-[5-[(E)-cinnamyl]sulf…
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) | 6.11 | 12.3 | -14.59 | 1 | 5 | 0 | 64 | 425.579 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.18 | 10.62 | -47.77 | 0 | 5 | -1 | 70 | 424.571 | 10 | ↓ |