In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | No |
Popular Name: 4-[[4-(3-chloropropylsulfonyl)piperazin-1-yl]methyl]-2-methyl-thiazole 4-[[4-(3-chloropropylsulfonyl)pi…
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 | 2.61 | -13.1 | 0 | 5 | 0 | 54 | 337.898 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 4.83 | -45.66 | 1 | 5 | 1 | 55 | 338.906 | 6 | ↓ |