General Information of the Compound
| Compound ID |
CP0959336
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| Compound Name |
(R)-3-ethoxy-5-(6-(((2-((N-hydroxyformamido)methyl)heptanamidomethyl)carbamoyl)pyridin-2-yl)benzoic acid
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| Structure |
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| Formula |
C25H32N4O7
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| Molecular Weight |
500.552
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| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cccc(-c2cc(OCC)cc(C(=O)O)c2)n1
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| InChI |
InChI=1S/C25H32N4O7/c1-3-5-6-8-17(14-29(35)16-30)23(31)26-15-27-24(32)22-10-7-9-21(28-22)18-11-19(25(33)34)13-20(12-18)36-4-2/h7,9-13,16-17,35H,3-6,8,14-15H2,1-2H3,(H,26,31)(H,27,32)(H,33,34)/t17-/m1/s1
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| InChIKey |
WBMZQEFPLSXGPI-QGZVFWFLSA-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