In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2004 | 31 | Yes |
Popular Name: 1-hexyl-4-keto-3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]quinolin-2-olate 1-hexyl-4-keto-3-[(6-methyl-1,3-…
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) | 5.09 | 13.02 | -60.9 | 1 | 6 | -1 | 87 | 434.541 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.16 | 11.62 | -152.79 | 0 | 6 | -2 | 93 | 433.533 | 7 | ↓ |