General Information of the Compound
| Compound ID |
CP0920160
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| Compound Name |
endo-8-(bis(2-chlorophenyl)methyl)-3-(5-methylpyridin-2-yl)-8-azabicyclo[3.2.1]octane-3-carboxamide
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| Formula |
C27H27Cl2N3O
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| Molecular Weight |
480.439
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| Canonical SMILES |
Cc1ccc([C@@]2(C(N)=O)C[C@H]3CC[C@@H](C2)N3C(c2ccccc2Cl)c2ccccc2Cl)nc1
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| InChI |
InChI=1S/C27H27Cl2N3O/c1-17-10-13-24(31-16-17)27(26(30)33)14-18-11-12-19(15-27)32(18)25(20-6-2-4-8-22(20)28)21-7-3-5-9-23(21)29/h2-10,13,16,18-19,25H,11-12,14-15H2,1H3,(H2,30,33)/t18-,19+,27-
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| InChIKey |
DUVZMQWDCJPBLG-MZNYFNKISA-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