General Information of the Compound
| Compound ID |
CP0408274
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| Compound Name |
3-[5-[4-(3-chlorophenyl)piperazin-1-yl]pentyl]-2-methylquinazolin-4-one
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| Structure |
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| Formula |
C24H29ClN4O
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| Molecular Weight |
424.976
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| Canonical SMILES |
Cc1nc2ccccc2c(=O)n1CCCCCN1CCN(CC1)c1cccc(Cl)c1
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| InChI |
InChI=1S/C24H29ClN4O/c1-19-26-23-11-4-3-10-22(23)24(30)29(19)13-6-2-5-12-27-14-16-28(17-15-27)21-9-7-8-20(25)18-21/h3-4,7-11,18H,2,5-6,12-17H2,1H3
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| InChIKey |
IUHLOLZVDWRWFT-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7