General Information of the Compound
| Compound ID |
CP0465214
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| Compound Name |
1-{1-[1-(9H-Fluoren-2-yl)-ethyl]-piperidin-4-yl}-1,3-dihydro-indol-2-one
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| Structure |
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| Formula |
C28H28N2O
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| Molecular Weight |
408.545
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| Canonical SMILES |
CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc-2c(Cc3ccccc-23)c1
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| InChI |
InChI=1S/C28H28N2O/c1-19(20-10-11-26-23(16-20)17-21-6-2-4-8-25(21)26)29-14-12-24(13-15-29)30-27-9-5-3-7-22(27)18-28(30)31/h2-11,16,19,24H,12-15,17-18H2,1H3
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| InChIKey |
QPOLDKMLCWYJNP-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: PT00983, Kappa-type opioid receptor
Protein ID: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor