General Information of the Compound
| Compound ID |
CP0566225
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| Compound Name |
N-[(1S,2S)-2-hydroxycyclohexyl]-5-[[4-[(3R)-3-methoxypyrrolidin-1-yl]phenyl]methyl]-1,6-dimethyl-2-oxopyridine-3-carboxamide
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| Formula |
C26H35N3O4
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| Molecular Weight |
453.583
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| Canonical SMILES |
CO[C@@H]1CCN(C1)c1ccc(Cc2cc(C(=O)N[C@H]3CCCC[C@@H]3O)c(=O)n(C)c2C)cc1
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| InChI |
InChI=1S/C26H35N3O4/c1-17-19(14-18-8-10-20(11-9-18)29-13-12-21(16-29)33-3)15-22(26(32)28(17)2)25(31)27-23-6-4-5-7-24(23)30/h8-11,15,21,23-24,30H,4-7,12-14,16H2,1-3H3,(H,27,31)/t21-,23+,24+/m1/s1
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| InChIKey |
QIKBSXNGZUTBFE-NHTMILBNSA-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