In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 29 | Yes |
Popular Name: [4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone [4-(5,7-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) | 4.75 | 11.86 | -12.18 | 0 | 4 | 0 | 36 | 419.472 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.75 | 12.24 | -33.36 | 1 | 4 | 1 | 38 | 420.48 | 3 | ↓ |