General Information of the Compound
| Compound ID |
CP0535809
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| Compound Name |
8-butyl-2-(2-methoxyphenyl)-2,8-diazaspiro[4.5]decane
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| Structure |
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| Formula |
C19H30N2O
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| Molecular Weight |
302.462
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| Canonical SMILES |
CCCCN1CCC2(CCN(C2)c2ccccc2OC)CC1
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| InChI |
InChI=1S/C19H30N2O/c1-3-4-12-20-13-9-19(10-14-20)11-15-21(16-19)17-7-5-6-8-18(17)22-2/h5-8H,3-4,9-16H2,1-2H3
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| InChIKey |
FXUMDUOHWITHIX-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor