In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 29 | Yes |
Popular Name: N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]-3-(trifluoromethoxy)benzenesulfonamide N-[3-[(E)-2-(2-pyridyl)vinyl]phe…
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) | 4.83 | 7.64 | -12.11 | 1 | 5 | 0 | 68 | 420.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.83 | 7.71 | -43.76 | 0 | 5 | -1 | 70 | 419.404 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.83 | 7.95 | -42.54 | 2 | 5 | 1 | 70 | 421.42 | 7 | ↓ |