General Information of the Compound
| Compound ID |
CP0467624
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| Compound Name |
(4R)-1-cyclohexyl-3-[1-[[4-(2-methyltetrazol-5-yl)phenyl]methyl]piperidin-4-yl]-4-phenylimidazolidin-2-one
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| Structure |
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| Formula |
C29H37N7O
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| Molecular Weight |
499.663
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| Canonical SMILES |
Cn1nnc(n1)-c1ccc(CN2CCC(CC2)N2[C@@H](CN(C3CCCCC3)C2=O)c2ccccc2)cc1
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| InChI |
InChI=1S/C29H37N7O/c1-33-31-28(30-32-33)24-14-12-22(13-15-24)20-34-18-16-26(17-19-34)36-27(23-8-4-2-5-9-23)21-35(29(36)37)25-10-6-3-7-11-25/h2,4-5,8-9,12-15,25-27H,3,6-7,10-11,16-21H2,1H3/t27-/m0/s1
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| InChIKey |
JUZAELHUYZBTDG-MHZLTWQESA-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