In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 29 | Yes |
Popular Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-methylsulfonylphenyl)methanone [4-(5,6-dimethyl-1,3-benzothiazo…
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) | 2.72 | 8.31 | -18.76 | 0 | 6 | 0 | 71 | 429.567 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.72 | 8.68 | -38.77 | 1 | 6 | 1 | 72 | 430.575 | 3 | ↓ |