General Information of the Compound
| Compound ID |
CP0464536
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| Compound Name |
N-(2-aminoethyl)-2-naphthalen-2-yloxy-N-spiro[5.5]undecan-3-ylacetamide
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| Structure |
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| Formula |
C25H34N2O2
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| Molecular Weight |
394.559
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| Canonical SMILES |
NCCN(C1CCC2(CCCCC2)CC1)C(=O)COc1ccc2ccccc2c1
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| InChI |
InChI=1S/C25H34N2O2/c26-16-17-27(22-10-14-25(15-11-22)12-4-1-5-13-25)24(28)19-29-23-9-8-20-6-2-3-7-21(20)18-23/h2-3,6-9,18,22H,1,4-5,10-17,19,26H2
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| InChIKey |
XZBPEHLEYCPQBU-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: PT01325, Melanocortin receptor 3
Protein ID: PT00914, Melanocortin receptor 4
Protein ID: PT01804, Melanocortin receptor 5
Protein ID: PT01440, Melanocyte-stimulating hormone receptor