In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2010 | 24 | Yes |
Popular Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-1H-quinoline-3-carboxamide N-(6-methyl-1,3-benzothiazol-2-y…
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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) | 2.51 | 8.37 | -19.66 | 2 | 5 | 0 | 75 | 335.388 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 7.85 | -73.31 | 1 | 5 | -1 | 81 | 334.38 | 2 | ↓ |