General Information of the Compound
| Compound ID |
CP0449632
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| Compound Name |
N-[3-[4-[3-cyclohexyl-5-(2-methylphenyl)-2-oxoimidazolidin-1-yl]piperidin-1-yl]butyl]-4,6-dimethylpyrimidine-5-carboxamide
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| Structure |
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| Formula |
C32H46N6O2
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| Molecular Weight |
546.76
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| Canonical SMILES |
CC(CCNC(=O)c1c(C)ncnc1C)N1CCC(CC1)N1C(CN(C2CCCCC2)C1=O)c1ccccc1C
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| InChI |
InChI=1S/C32H46N6O2/c1-22-10-8-9-13-28(22)29-20-37(26-11-6-5-7-12-26)32(40)38(29)27-15-18-36(19-16-27)23(2)14-17-33-31(39)30-24(3)34-21-35-25(30)4/h8-10,13,21,23,26-27,29H,5-7,11-12,14-20H2,1-4H3,(H,33,39)
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| InChIKey |
MZSUZRLLPGOZDL-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