General Information of the Compound
| Compound ID |
CP0946251
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| Compound Name |
5-(6-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)pyridin-2-yl)-2-methoxybenzoic acid
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| Structure |
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| Formula |
C26H34N4O7
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| Molecular Weight |
514.579
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1cccc(-c2ccc(OC)c(C(=O)O)c2)n1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C26H34N4O7/c1-4-6-7-9-18(22(5-2)30(36)16-31)24(32)27-15-28-25(33)21-11-8-10-20(29-21)17-12-13-23(37-3)19(14-17)26(34)35/h8,10-14,16,18,22,36H,4-7,9,15H2,1-3H3,(H,27,32)(H,28,33)(H,34,35)/t18-,22-/m1/s1
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| InChIKey |
DRHLNSZKPFJMIB-XMSQKQJNSA-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