General Information of the Compound
| Compound ID |
CP0902592
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| Compound Name |
(R)-tert-butyl 3-(5-(((2-((N-hydroxyformamido)methyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzoate
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| Structure |
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| Formula |
C26H35N3O7
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| Molecular Weight |
501.58
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| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1ccc(-c2cccc(C(=O)OC(C)(C)C)c2)o1
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| InChI |
InChI=1S/C26H35N3O7/c1-5-6-7-9-20(15-29(34)17-30)23(31)27-16-28-24(32)22-13-12-21(35-22)18-10-8-11-19(14-18)25(33)36-26(2,3)4/h8,10-14,17,20,34H,5-7,9,15-16H2,1-4H3,(H,27,31)(H,28,32)/t20-/m1/s1
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| InChIKey |
CAFLZHQAYGOKPU-HXUWFJFHSA-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