General Information of the Compound
| Compound ID |
CP0378122
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| Compound Name |
dec-9-enoxy-dihydroxy-sulfanylidene-lambda5-phosphane
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| Synonyms |
9-Decen-1-ol, dihydrogen phosphorothioate
BDBM50170855
CHEMBL363935
SCHEMBL192854
Thiophosphoric acid dec-9-enyl ester
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| Structure |
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| Formula |
C10H21O3PS
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| Molecular Weight |
252.316
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| Canonical SMILES |
OP(O)(=S)OCCCCCCCCC=C
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| InChI |
InChI=1S/C10H21O3PS/c1-2-3-4-5-6-7-8-9-10-13-14(11,12)15/h2H,1,3-10H2,(H2,11,12,15)
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| InChIKey |
LWVBJTXDTCXEJG-UHFFFAOYSA-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: PT04536, Lysophosphatidic acid receptor 2
Protein ID: PT02824, Lysophosphatidic acid receptor 3
Clinical Information about the Compound