General Information of the Compound
| Compound ID |
CP0958576
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| Compound Name |
(3-hydroxy-5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)phenyl)phosphonic acid
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| Structure |
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| Formula |
C23H32N3O9P
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| Molecular Weight |
525.495
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(O)cc(P(=O)(O)O)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C23H32N3O9P/c1-3-5-6-7-18(19(4-2)26(31)14-27)22(29)24-13-25-23(30)21-9-8-20(35-21)15-10-16(28)12-17(11-15)36(32,33)34/h8-12,14,18-19,28,31H,3-7,13H2,1-2H3,(H,24,29)(H,25,30)(H2,32,33,34)/t18-,19-/m1/s1
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| InChIKey |
DHSDRWLAPMLALK-RTBURBONSA-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