General Information of the Compound
| Compound ID |
CP0946391
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| Compound Name |
(R)-N-((2-((N-hydroxyformamido)methyl)heptanamido)methyl)-3'-(2,2,2-trifIuoroethoxy)-[1,1'-biphenyl]-3-carboxamide
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| Structure |
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| Formula |
C25H30F3N3O5
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| Molecular Weight |
509.525
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| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cccc(-c2cccc(OCC(F)(F)F)c2)c1
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| InChI |
InChI=1S/C25H30F3N3O5/c1-2-3-4-7-21(14-31(35)17-32)24(34)30-16-29-23(33)20-10-5-8-18(12-20)19-9-6-11-22(13-19)36-15-25(26,27)28/h5-6,8-13,17,21,35H,2-4,7,14-16H2,1H3,(H,29,33)(H,30,34)/t21-/m1/s1
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| InChIKey |
JSDOYOYOZRCABS-OAQYLSRUSA-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