General Information of the Compound
| Compound ID |
CP0428318
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| Compound Name |
2-hydroxyethyl-[(E)-14-iodotetradec-13-en-3,5-diynoxy]phosphinic acid
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| Structure |
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| Formula |
C16H24IO4P
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| Molecular Weight |
438.242
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| Canonical SMILES |
OCCP(O)(=O)OCCC#CC#CCCCCCC\C=C\I
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| InChI |
InChI=1S/C16H24IO4P/c17-13-11-9-7-5-3-1-2-4-6-8-10-12-15-21-22(19,20)16-14-18/h11,13,18H,1-3,5,7,9,12,14-16H2,(H,19,20)/b13-11+
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| InChIKey |
SPLMHQCLYOPLPK-ACCUITESSA-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