General Information of the Compound
| Compound ID |
CP0859703
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| Compound Name |
1-(2-(azepan-1-yl)ethyl)-3-phenylimidazolidin-2-one
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| Structure |
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| Formula |
C17H25N3O
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| Molecular Weight |
287.407
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| Canonical SMILES |
O=C1N(CCN2CCCCCC2)CCN1c1ccccc1
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| InChI |
InChI=1S/C17H25N3O/c21-17-19(13-12-18-10-6-1-2-7-11-18)14-15-20(17)16-8-4-3-5-9-16/h3-5,8-9H,1-2,6-7,10-15H2
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| InChIKey |
NBYFBVZSSQUNTB-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