General Information of the Compound
| Compound ID |
CP0391724
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| Compound Name |
N-[3-[4-[(5R)-3-tert-butyl-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 |
C30H42ClN5O2
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| Molecular Weight |
540.152
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| Canonical SMILES |
CC(CCNC(=O)c1c(C)cc(Cl)nc1C)N1CCC(CC1)N1[C@@H](CN(C1=O)C(C)(C)C)c1ccccc1
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| InChI |
InChI=1S/C30H42ClN5O2/c1-20-18-26(31)33-22(3)27(20)28(37)32-15-12-21(2)34-16-13-24(14-17-34)36-25(23-10-8-7-9-11-23)19-35(29(36)38)30(4,5)6/h7-11,18,21,24-25H,12-17,19H2,1-6H3,(H,32,37)/t21?,25-/m0/s1
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| InChIKey |
COOGUPBOWLTOIX-QBGQUKIHSA-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