General Information of the Compound
| Compound ID |
CP0389324
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| Compound Name |
N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropyl]-5-methyl-1,2-diphenylimidazole-4-carboxamide
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| Structure |
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| Formula |
C32H37N5O2
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| Molecular Weight |
523.681
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| Canonical SMILES |
Cc1c(nc(-c2ccccc2)n1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(C)c1C
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| InChI |
InChI=1S/C32H37N5O2/c1-23-11-10-16-29(24(23)2)36-19-17-35(18-20-36)22-28(38)21-33-32(39)30-25(3)37(27-14-8-5-9-15-27)31(34-30)26-12-6-4-7-13-26/h4-16,28,38H,17-22H2,1-3H3,(H,33,39)
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| InChIKey |
UDZQCEVTHMQRHA-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT00871, Sodium-dependent serotonin transporter