General Information of the Compound
| Compound ID |
CP0201571
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| Compound Name |
1-[2-(1,3-dihydroisoindol-2-yl)ethyl]-3-(5-methylthiophen-2-yl)imidazolidin-2-one
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| Structure |
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| Formula |
C18H21N3OS
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| Molecular Weight |
327.453
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| Canonical SMILES |
Cc1ccc(s1)N1CCN(CCN2Cc3ccccc3C2)C1=O
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| InChI |
InChI=1S/C18H21N3OS/c1-14-6-7-17(23-14)21-11-10-20(18(21)22)9-8-19-12-15-4-2-3-5-16(15)13-19/h2-7H,8-13H2,1H3
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| InChIKey |
TTYSBVYYRWWKNF-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