General Information of the Compound
| Compound ID |
CP0507833
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| Compound Name |
(S)-3-(4-benzamidophenyl)-2-((4R,5R)-5-(biphenyl-2-ylcarbamoyl)-1,3-dioxolane-4-carboxamido)propanoic acid
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| Structure |
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| Formula |
C33H29N3O7
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| Molecular Weight |
579.609
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| Canonical SMILES |
OC(=O)[C@H](Cc1ccc(NC(=O)c2ccccc2)cc1)NC(=O)[C@@H]1OCO[C@H]1C(=O)Nc1ccccc1-c1ccccc1
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| InChI |
InChI=1S/C33H29N3O7/c37-30(23-11-5-2-6-12-23)34-24-17-15-21(16-18-24)19-27(33(40)41)36-32(39)29-28(42-20-43-29)31(38)35-26-14-8-7-13-25(26)22-9-3-1-4-10-22/h1-18,27-29H,19-20H2,(H,34,37)(H,35,38)(H,36,39)(H,40,41)/t27-,28+,29+/m0/s1
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| InChIKey |
UDEKZLOXTIWIBM-ZGIBFIJWSA-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