General Information of the Compound
| Compound ID |
CP0887680
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| Compound Name |
(R)-2,2'-difluoro-N-((2-((N-hydroxyformamido)methyl)heptanamido)methyl)-3'-methoxy-[1,1'-biphenyl]-3-carboxamide
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| Structure |
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| Formula |
C26H33F2N3O5
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| Molecular Weight |
505.562
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1cccc(-c2cccc(OC)c2F)c1F)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C26H33F2N3O5/c1-4-6-7-10-19(21(5-2)31(35)16-32)25(33)29-15-30-26(34)20-13-8-11-17(23(20)27)18-12-9-14-22(36-3)24(18)28/h8-9,11-14,16,19,21,35H,4-7,10,15H2,1-3H3,(H,29,33)(H,30,34)/t19-,21-/m1/s1
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| InChIKey |
YQDBEFXMHHVBCZ-TZIWHRDSSA-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