In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 20 | Yes |
Popular Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamine 2-[4-(3,4-dimethylphenyl)sulfony…
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) | 0.77 | 1.27 | -52.77 | 3 | 5 | 1 | 68 | 298.432 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 3.6 | -129.23 | 4 | 5 | 2 | 69 | 299.44 | 4 | ↓ |