In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 26 | Yes |
Popular Name: 2-chloro-4-methyl-N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]benzenesulfonamide 2-chloro-4-methyl-N-[3-[(E)-2-(2…
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) | 4.94 | 9.06 | -12.46 | 1 | 4 | 0 | 59 | 384.888 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.94 | 9.13 | -48.42 | 0 | 4 | -1 | 61 | 383.88 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.94 | 9.37 | -42.98 | 2 | 4 | 1 | 60 | 385.896 | 5 | ↓ |