In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 28 | Yes |
Popular Name: N-[5-[(E)-cinnamyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide N-[5-[(E)-cinnamyl]sulfanyl-1,3,…
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) | 5.78 | 12.74 | -17.23 | 1 | 4 | 0 | 55 | 403.532 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.84 | 11.88 | -52.73 | 0 | 4 | -1 | 61 | 402.524 | 6 | ↓ |