General Information of the Compound
| Compound ID |
CP0901501
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| Compound Name |
(R)-3-ethoxy-5-(5-(((2-((N-hydroxyformamido)methyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzoic acid
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| Structure |
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| Formula |
C24H31N3O8
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| Molecular Weight |
489.525
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| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1ccc(-c2cc(OCC)cc(C(=O)O)c2)o1
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| InChI |
InChI=1S/C24H31N3O8/c1-3-5-6-7-16(13-27(33)15-28)22(29)25-14-26-23(30)21-9-8-20(35-21)17-10-18(24(31)32)12-19(11-17)34-4-2/h8-12,15-16,33H,3-7,13-14H2,1-2H3,(H,25,29)(H,26,30)(H,31,32)/t16-/m1/s1
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| InChIKey |
BRHPGJGDRPZCNS-MRXNPFEDSA-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