General Information of the Compound
| Compound ID |
CP0903913
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| Compound Name |
2-(dimethylamino)-2-oxoethyl 4-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzoate
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| Structure |
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| Formula |
C28H38N4O8
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| Molecular Weight |
558.632
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2ccc(C(=O)OCC(=O)N(C)C)cc2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C28H38N4O8/c1-5-7-8-9-21(22(6-2)32(38)18-33)26(35)29-17-30-27(36)24-15-14-23(40-24)19-10-12-20(13-11-19)28(37)39-16-25(34)31(3)4/h10-15,18,21-22,38H,5-9,16-17H2,1-4H3,(H,29,35)(H,30,36)/t21-,22-/m1/s1
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| InChIKey |
QYPYCTJUTRJBNF-FGZHOGPDSA-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