General Information of the Compound
| Compound ID |
CP0905722
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| Compound Name |
((2-hydroxy-4-(6-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)pyridin-2-yl)benzamido)methyl)phosphonic acid
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| Structure |
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| Formula |
C26H36N5O9P
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| Molecular Weight |
593.574
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1cccc(-c2ccc(C(=O)NCP(=O)(O)O)c(O)c2)n1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C26H36N5O9P/c1-3-5-6-8-18(22(4-2)31(37)16-32)24(34)27-14-28-26(36)21-10-7-9-20(30-21)17-11-12-19(23(33)13-17)25(35)29-15-41(38,39)40/h7,9-13,16,18,22,33,37H,3-6,8,14-15H2,1-2H3,(H,27,34)(H,28,36)(H,29,35)(H2,38,39,40)/t18-,22-/m1/s1
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| InChIKey |
MVLOBSNDFDPHEJ-XMSQKQJNSA-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