| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 14 | No |
Popular Name: 5-Quinolinecarboxylic acid, 8-mercapto- (9CI) 5-Quinolinecarboxylic acid, 8-me…
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CAS Number: 732219-03-3
| 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) | 1.95 | 6.41 | -60.15 | 1 | 3 | -1 | 54 | 204.23 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 6.03 | -101.6 | 0 | 3 | -2 | 53 | 203.222 | 1 | ↓ |
