General Information of the Compound
| Compound ID |
CP0548209
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| Compound Name |
3-(2-methoxyphenyl)-3,9-diazaspiro[5.5]undecane
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| Structure |
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| Formula |
C16H24N2O
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| Molecular Weight |
260.381
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| Canonical SMILES |
COc1ccccc1N1CCC2(CCNCC2)CC1
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| InChI |
InChI=1S/C16H24N2O/c1-19-15-5-3-2-4-14(15)18-12-8-16(9-13-18)6-10-17-11-7-16/h2-5,17H,6-13H2,1H3
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| InChIKey |
IYTHNIHFDXEHOY-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