General Information of the Compound
| Compound ID |
CP0424508
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| Compound Name |
(5Z)-3-[3-[4-(2,3-dichlorophenyl)piperazin-1-yl]propyl]-5-[(3,4-dimethoxyphenyl)methylidene]imidazolidine-2,4-dione
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| Structure |
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| Formula |
C25H28Cl2N4O4
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| Molecular Weight |
519.429
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| Canonical SMILES |
COc1ccc(\C=C2/NC(=O)N(CCCN3CCN(CC3)c3cccc(Cl)c3Cl)C2=O)cc1OC
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| InChI |
InChI=1S/C25H28Cl2N4O4/c1-34-21-8-7-17(16-22(21)35-2)15-19-24(32)31(25(33)28-19)10-4-9-29-11-13-30(14-12-29)20-6-3-5-18(26)23(20)27/h3,5-8,15-16H,4,9-14H2,1-2H3,(H,28,33)/b19-15-
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| InChIKey |
PSZLBYHCRLTRDX-CYVLTUHYSA-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7