General Information of the Compound
| Compound ID |
CP0482514
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| Compound Name |
(2S)-4-methyl-2-[(2-phenyl-1-quinolin-4-ylimidazole-4-carbonyl)amino]pentanoic acid
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| Structure |
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| Formula |
C25H24N4O3
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| Molecular Weight |
428.492
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| Canonical SMILES |
CC(C)C[C@H](NC(=O)c1cn(c(n1)-c1ccccc1)-c1ccnc2ccccc12)C(O)=O
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| InChI |
InChI=1S/C25H24N4O3/c1-16(2)14-20(25(31)32)28-24(30)21-15-29(23(27-21)17-8-4-3-5-9-17)22-12-13-26-19-11-7-6-10-18(19)22/h3-13,15-16,20H,14H2,1-2H3,(H,28,30)(H,31,32)/t20-/m0/s1
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| InChIKey |
BVSRWZIQRFETGU-FQEVSTJZSA-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