General Information of the Compound
| Compound ID |
CP0887578
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| Compound Name |
3-[3-(4-Benzylpiperazin-1-yl)-2-hydroxypropyl]-5-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
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| Structure |
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| Formula |
C24H29FN4O3
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| Molecular Weight |
440.519
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| Canonical SMILES |
CC1(c2ccc(F)cc2)NC(=O)N(CC(O)CN2CCN(Cc3ccccc3)CC2)C1=O
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| InChI |
InChI=1S/C24H29FN4O3/c1-24(19-7-9-20(25)10-8-19)22(31)29(23(32)26-24)17-21(30)16-28-13-11-27(12-14-28)15-18-5-3-2-4-6-18/h2-10,21,30H,11-17H2,1H3,(H,26,32)
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| InChIKey |
AARLSAHQVGPBSH-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: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor