In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2009 | 26 | Yes |
Popular Name: 4-[[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]methyl]benzonitrile 4-[[4-(4-bromo-2-chloro-phenyl)s…
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) | 3.71 | 7 | -10.92 | 0 | 5 | 0 | 64 | 454.777 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 9.29 | -58.69 | 1 | 5 | 1 | 66 | 455.785 | 4 | ↓ |