General Information of the Compound
| Compound ID |
CP0502161
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| Compound Name |
N-[8-[bis(2-chlorophenyl)methyl]-3-phenyl-8-azabicyclo[3.2.1]octan-3-yl]cyclopropanecarboxamide
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| Structure |
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| Formula |
C30H30Cl2N2O
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| Molecular Weight |
505.489
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| Canonical SMILES |
Clc1ccccc1C(N1C2CCC1CC(C2)(NC(=O)C1CC1)c1ccccc1)c1ccccc1Cl
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| InChI |
InChI=1S/C30H30Cl2N2O/c31-26-12-6-4-10-24(26)28(25-11-5-7-13-27(25)32)34-22-16-17-23(34)19-30(18-22,21-8-2-1-3-9-21)33-29(35)20-14-15-20/h1-13,20,22-23,28H,14-19H2,(H,33,35)
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| InChIKey |
IQKRJMYITRFRAP-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