General Information of the Compound
| Compound ID |
CP0413861
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| Compound Name |
N-[3-[4-[(5R)-3-benzyl-2-oxo-5-phenylimidazolidin-1-yl]piperidin-1-yl]butyl]-6-chloro-2,4-dimethylpyridine-3-carboxamide
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| Structure |
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| Formula |
C33H40ClN5O2
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| Molecular Weight |
574.169
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| Canonical SMILES |
CC(CCNC(=O)c1c(C)cc(Cl)nc1C)N1CCC(CC1)N1[C@@H](CN(Cc2ccccc2)C1=O)c1ccccc1
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| InChI |
InChI=1S/C33H40ClN5O2/c1-23-20-30(34)36-25(3)31(23)32(40)35-17-14-24(2)37-18-15-28(16-19-37)39-29(27-12-8-5-9-13-27)22-38(33(39)41)21-26-10-6-4-7-11-26/h4-13,20,24,28-29H,14-19,21-22H2,1-3H3,(H,35,40)/t24?,29-/m0/s1
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| InChIKey |
QQPGVUMKWQYOEK-PEFOLFAWSA-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