General Information of the Compound
| Compound ID |
CP0883829
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| Compound Name |
N-(((R)-2-((S)-2-hydroxy-1-(N-(((hydroxyformamido)ethyl)heptanamido)methyl)-5-phenylfuran-2-carboxamide
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| Structure |
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| Formula |
C22H29N3O6
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| Molecular Weight |
431.489
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2ccccc2)o1)[C@@H](CO)N(O)C=O
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| InChI |
InChI=1S/C22H29N3O6/c1-2-3-5-10-17(18(13-26)25(30)15-27)21(28)23-14-24-22(29)20-12-11-19(31-20)16-8-6-4-7-9-16/h4,6-9,11-12,15,17-18,26,30H,2-3,5,10,13-14H2,1H3,(H,23,28)(H,24,29)/t17-,18-/m1/s1
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| InChIKey |
PRLYADUAEJNIGW-QZTJIDSGSA-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
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2