General Information of the Compound
| Compound ID |
CP0479765
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| Compound Name |
(2S)-2-[[2-(2,6-dimethoxyphenyl)-1-(4-methylphenyl)imidazole-4-carbonyl]amino]-4-methylpentanoic acid
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| Structure |
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| Formula |
C25H29N3O5
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| Molecular Weight |
451.523
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| Canonical SMILES |
COc1cccc(OC)c1-c1nc(cn1-c1ccc(C)cc1)C(=O)N[C@@H](CC(C)C)C(O)=O
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| InChI |
InChI=1S/C25H29N3O5/c1-15(2)13-18(25(30)31)27-24(29)19-14-28(17-11-9-16(3)10-12-17)23(26-19)22-20(32-4)7-6-8-21(22)33-5/h6-12,14-15,18H,13H2,1-5H3,(H,27,29)(H,30,31)/t18-/m0/s1
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| InChIKey |
JQUZETBZKCBLIE-SFHVURJKSA-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