| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2006 | 22 | Yes |
Popular Name: 3-chloro-N-[4-(cyanomethyl)phenyl]-4-methoxy-benzenesulfonamide 3-chloro-N-[4-(cyanomethyl)pheny…
| 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) | 3.33 | -1.73 | -15.59 | 1 | 5 | 0 | 79 | 336.8 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | -1.15 | -44.65 | 0 | 5 | -1 | 81 | 335.792 | 5 | ↓ |
