General Information of the Compound
| Compound ID |
CP0888017
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| Compound Name |
2-(4-(6-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)pyridin-2-yl)phenyl)-2-methylpropanoic acid
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| Structure |
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| Formula |
C28H38N4O6
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| Molecular Weight |
526.634
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1cccc(-c2ccc(C(C)(C)C(=O)O)cc2)n1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C28H38N4O6/c1-5-7-8-10-21(24(6-2)32(38)18-33)25(34)29-17-30-26(35)23-12-9-11-22(31-23)19-13-15-20(16-14-19)28(3,4)27(36)37/h9,11-16,18,21,24,38H,5-8,10,17H2,1-4H3,(H,29,34)(H,30,35)(H,36,37)/t21-,24-/m1/s1
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| InChIKey |
QLNNFHOKQULRKO-ZJSXRUAMSA-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