General Information of the Compound
| Compound ID |
CP0532401
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| Compound Name |
2-Benzhydryl-3-benzyloxy-1-aza-bicyclo[2.2.2]octane
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| Structure |
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| Formula |
C27H29NO
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| Molecular Weight |
383.535
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| Canonical SMILES |
C(OC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C27H29NO/c1-4-10-21(11-5-1)20-29-27-24-16-18-28(19-17-24)26(27)25(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-27H,16-20H2
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| InChIKey |
ZNUJWZLCROWJAJ-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound