General Information of the Compound
| Compound ID |
CP0155068
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| Compound Name |
(2-(6-amino-9H-purin-9-yl)ethoxy)methylphosphonic acid
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| Synonyms |
((2-(6-Amino-9H-purin-9-yl)ethoxy)methyl)phosphonic acid
106941-25-7
2-(6-aminopurin-9-yl)ethoxymethylphosphonic acid
6GQP90I798
9-(2-(Phosphonomethoxy)ethyl)adenine
9-(2-Phosphonylmethoxyethyl)adenine
ADEFOVIR
BRN 3561094
C8H12N5O4P
CHEMBL484
DRG-0156
GS 0393
GS 393
GS-0393
HSDB 8079
N-(2-Phophonomethoxyethyl-2,6-diaminopurine)
N-(2-Phosphonylmethoxyethyl)adenine
PMEA
Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-
UNII-6GQP90I798
{[2-(6-Amino-9h-Purin-9-Yl)ethoxy]methyl}phosphonic Acid
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| Structure |
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| Formula |
C8H12N5O4P
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| Molecular Weight |
273.189
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| Canonical SMILES |
Nc1ncnc2n(CCOCP(O)(O)=O)cnc12
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| InChI |
InChI=1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)
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| InChIKey |
SUPKOOSCJHTBAH-UHFFFAOYSA-N
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| CAS |
106941-25-7
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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: PT00295, Capsid protein
Protein ID: PT04064, Solute carrier family 22 member 6
Clinical Information about the Compound