In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | Yes |
Popular Name: 5-(1,3-benzodioxol-5-yl)pyridine-3-carboxylic 5-(1,3-benzodioxol-5-yl)pyridine…
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CAS Number: 842170-41-6
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) | 2.11 | 4.39 | -47.28 | 0 | 5 | -1 | 71 | 242.21 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 4.81 | -51.5 | 1 | 5 | 0 | 73 | 243.218 | 2 | ↓ |