General Information of the Compound
| Compound ID |
CP0902597
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| Compound Name |
2-((3-ethoxy-5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzyl)(methyl)amino)acetic acid
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| Structure |
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| Formula |
C29H42N4O8
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| Molecular Weight |
574.675
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(CN(C)CC(=O)O)cc(OCC)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C29H42N4O8/c1-5-8-9-10-23(24(6-2)33(39)19-34)28(37)30-18-31-29(38)26-12-11-25(41-26)21-13-20(14-22(15-21)40-7-3)16-32(4)17-27(35)36/h11-15,19,23-24,39H,5-10,16-18H2,1-4H3,(H,30,37)(H,31,38)(H,35,36)/t23-,24-/m1/s1
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| InChIKey |
VOIDFWWWMVOASZ-DNQXCXABSA-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