General Information of the Compound
| Compound ID |
CP0880342
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| Compound Name |
1-(2-(azepan-1-yl)ethyl)-3-o-tolylimidazolidin-2-one
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| Structure |
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| Formula |
C18H27N3O
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| Molecular Weight |
301.434
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| Canonical SMILES |
Cc1ccccc1N1CCN(CCN2CCCCCC2)C1=O
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| InChI |
InChI=1S/C18H27N3O/c1-16-8-4-5-9-17(16)21-15-14-20(18(21)22)13-12-19-10-6-2-3-7-11-19/h4-5,8-9H,2-3,6-7,10-15H2,1H3
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| InChIKey |
DEWALVCCVMLGFD-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