In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 17 | Yes |
Popular Name: 4-Phenylbicyclo[2.2.2]octane-1-carboxylic acid 4-Phenylbicyclo[2.2.2]octane-1-c…
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CAS Number: 953-69-5
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) | 2.64 | 9.32 | -47.64 | 0 | 2 | -1 | 40 | 229.299 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.64 | 7.37 | -5.29 | 1 | 2 | 0 | 37 | 230.307 | 2 | ↓ |