In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 28 | Yes |
Popular Name: [2-[[5-[(E)-cinnamyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl] [2-[[5-[(E)-cinnamyl]sulfanyl-1,…
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) | 4.67 | 12.44 | -20.55 | 1 | 6 | 0 | 81 | 411.508 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.19 | 10.77 | -57.4 | 0 | 6 | -1 | 88 | 410.5 | 8 | ↓ |