General Information of the Compound
| Compound ID |
CP0409008
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| Compound Name |
N-[3-[4-(3-cyclohexyl-2-oxo-5-pyridin-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-4,6-dimethylpyrimidine-5-carboxamide
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| Structure |
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| Formula |
C30H43N7O2
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| Molecular Weight |
533.721
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| Canonical SMILES |
CC(CCNC(=O)c1c(C)ncnc1C)N1CCC(CC1)N1C(CN(C2CCCCC2)C1=O)c1cccnc1
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| InChI |
InChI=1S/C30H43N7O2/c1-21(11-15-32-29(38)28-22(2)33-20-34-23(28)3)35-16-12-26(13-17-35)37-27(24-8-7-14-31-18-24)19-36(30(37)39)25-9-5-4-6-10-25/h7-8,14,18,20-21,25-27H,4-6,9-13,15-17,19H2,1-3H3,(H,32,38)
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| InChIKey |
NAECBSHMFGJZKH-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