General Information of the Compound
| Compound ID |
CP0952389
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| Compound Name |
(R)-N-((3-cyclopentyl-2-((N-hydroxyformamido)methyl)propanamido)methyl)-3'-(trifluoromethyl)-[1,1'-biphenyl]-3-carboxamide
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| Structure |
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| Formula |
C25H28F3N3O4
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| Molecular Weight |
491.51
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| Canonical SMILES |
O=CN(O)C[C@@H](CC1CCCC1)C(=O)NCNC(=O)c1cccc(-c2cccc(C(F)(F)F)c2)c1
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| InChI |
InChI=1S/C25H28F3N3O4/c26-25(27,28)22-10-4-8-19(13-22)18-7-3-9-20(12-18)23(33)29-15-30-24(34)21(14-31(35)16-32)11-17-5-1-2-6-17/h3-4,7-10,12-13,16-17,21,35H,1-2,5-6,11,14-15H2,(H,29,33)(H,30,34)/t21-/m1/s1
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| InChIKey |
LXQMNRZCLNMNHU-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