General Information of the Compound
| Compound ID |
CP0920426
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| Compound Name |
N,N-Dimethyl-1-[3-(4-o-tolylpiperidin-1-yl)propanoyl]indoline-(2RS)-2-carboxamide
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| Structure |
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| Formula |
C26H33N3O2
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| Molecular Weight |
419.569
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| Canonical SMILES |
Cc1ccccc1C1CCN(CCC(=O)N2c3ccccc3CC2C(=O)N(C)C)CC1
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| InChI |
InChI=1S/C26H33N3O2/c1-19-8-4-6-10-22(19)20-12-15-28(16-13-20)17-14-25(30)29-23-11-7-5-9-21(23)18-24(29)26(31)27(2)3/h4-11,20,24H,12-18H2,1-3H3
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| InChIKey |
VQFSMIZJZKBHKC-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