General Information of the Compound
| Compound ID |
CP0464386
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| Compound Name |
(2S)-2-[[2-(1H-imidazol-5-yl)acetyl]amino]-N-(4-phenoxyphenyl)-3-phenylmethoxypropanamide
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| Structure |
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| Formula |
C27H26N4O4
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| Molecular Weight |
470.529
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| Canonical SMILES |
O=C(Cc1cnc[nH]1)N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C27H26N4O4/c32-26(15-22-16-28-19-29-22)31-25(18-34-17-20-7-3-1-4-8-20)27(33)30-21-11-13-24(14-12-21)35-23-9-5-2-6-10-23/h1-14,16,19,25H,15,17-18H2,(H,28,29)(H,30,33)(H,31,32)/t25-/m0/s1
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| InChIKey |
OTVCDROFRMXUDM-VWLOTQADSA-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