General Information of the Compound
| Compound ID |
CP0874426
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| Compound Name |
5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)nicotinic acid
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| Structure |
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| Formula |
C23H30N4O7
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| Molecular Weight |
474.514
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cncc(C(=O)O)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C23H30N4O7/c1-3-5-6-7-17(18(4-2)27(33)14-28)21(29)25-13-26-22(30)20-9-8-19(34-20)15-10-16(23(31)32)12-24-11-15/h8-12,14,17-18,33H,3-7,13H2,1-2H3,(H,25,29)(H,26,30)(H,31,32)/t17-,18-/m1/s1
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| InChIKey |
KVJPULCOPXGRLR-QZTJIDSGSA-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