General Information of the Compound
| Compound ID |
CP0907441
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| Compound Name |
(R)-N-((2-((N-hydroxyformamido)methyl)heptanamido)methyl)-3-(2-methoxypyrimidin-4-yl)benzamide
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| Structure |
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| Formula |
C22H29N5O5
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| Molecular Weight |
443.504
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| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cccc(-c2ccnc(OC)n2)c1
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| InChI |
InChI=1S/C22H29N5O5/c1-3-4-5-7-18(13-27(31)15-28)21(30)25-14-24-20(29)17-9-6-8-16(12-17)19-10-11-23-22(26-19)32-2/h6,8-12,15,18,31H,3-5,7,13-14H2,1-2H3,(H,24,29)(H,25,30)/t18-/m1/s1
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| InChIKey |
VSKHYENQVDBHGA-GOSISDBHSA-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