General Information of the Compound
| Compound ID |
CP0654478
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| Compound Name |
1-(benzo[d][1,3]dioxol-5-yl)-3-(2-(((-7,7-dimethylbicyclo[2.2.1]heptan-1-yl)methyl)(methyl)amino)ethyl)imidazolidin-2-one
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| Formula |
C23H33N3O3
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| Molecular Weight |
399.535
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| Canonical SMILES |
CN(CCN1CCN(c2ccc3c(c2)OCO3)C1=O)C[C@]12CC[C@H](CC1)C2(C)C
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| InChI |
InChI=1S/C23H33N3O3/c1-22(2)17-6-8-23(22,9-7-17)15-24(3)10-11-25-12-13-26(21(25)27)18-4-5-19-20(14-18)29-16-28-19/h4-5,14,17H,6-13,15-16H2,1-3H3/t17-,23+
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| InChIKey |
ABSKTFYOWZQKEU-LBEPJEHYSA-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