General Information of the Compound
| Compound ID |
CP0428369
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| Compound Name |
(8-(bis(2-chlorophenyl)methyl)-3-phenyl-8-azabicyclo[3.2.1]octan-3-yl)methanol
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| Structure |
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| Formula |
C27H27Cl2NO
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| Molecular Weight |
452.425
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| Canonical SMILES |
OCC1(CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl)c1ccccc1
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| InChI |
InChI=1S/C27H27Cl2NO/c28-24-12-6-4-10-22(24)26(23-11-5-7-13-25(23)29)30-20-14-15-21(30)17-27(16-20,18-31)19-8-2-1-3-9-19/h1-13,20-21,26,31H,14-18H2
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| InChIKey |
ANLLPDOAFMYHJC-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
Protein ID: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor