General Information of the Compound
| Compound ID |
CP0511852
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| Compound Name |
(2S)-2-[[2-(1H-imidazol-5-yl)acetyl]-methylamino]-N-(4-phenoxyphenyl)-3-phenylmethoxypropanamide
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| Structure |
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| Formula |
C28H28N4O4
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| Molecular Weight |
484.556
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| Canonical SMILES |
CN([C@@H](COCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)cc1)C(=O)Cc1cnc[nH]1
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| InChI |
InChI=1S/C28H28N4O4/c1-32(27(33)16-23-17-29-20-30-23)26(19-35-18-21-8-4-2-5-9-21)28(34)31-22-12-14-25(15-13-22)36-24-10-6-3-7-11-24/h2-15,17,20,26H,16,18-19H2,1H3,(H,29,30)(H,31,34)/t26-/m0/s1
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| InChIKey |
BMHSCBQREOFXHI-SANMLTNESA-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