Determine the necessary mass, volume, or concentration for preparing a solution.
Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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SKU | Size | Availability | Price | Qty |
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R130529-1mg | 1mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $68.90 | |
R130529-5mg | 5mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $206.90 | |
R130529-10mg | 10mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $325.90 |
S1P1and S1P3antagonist
Synonyms | VPC 230192-Amino-N-(3-octylphenyl)-3-(phosphonooxy)-propanamaide |
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Specifications & Purity | Moligand™, ≥99% |
Biochemical and Physiological Mechanisms | Sphingosine-1-phosphate receptor antagonist; inhibits S1P1and S1P3receptors (pKivalues are 7.86 and 5.93 respectively). |
Shipped In | Normal |
Grade | Moligand™ |
Action Type | ANTAGONIST |
Mechanism of action | Antagonist of S1P 1 receptor;Antagonist of S1P 3 receptor |
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IUPAC Name | [(2R)-2-amino-3-(3-octylanilino)-3-oxopropyl] dihydrogen phosphate |
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INCHI | InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-9-14-10-8-11-15(12-14)19-17(20)16(18)13-24-25(21,22)23/h8,10-12,16H,2-7,9,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1 |
InChi Key | MRUSUGVVWGNKFE-MRXNPFEDSA-N |
Canonical SMILES | CCCCCCCCC1=CC(=CC=C1)NC(=O)C(COP(=O)(O)O)N |
Isomeric SMILES | CCCCCCCCC1=CC(=CC=C1)NC(=O)[C@@H](COP(=O)(O)O)N |
PubChem CID | 11588811 |
Molecular Weight | 372.396 |
PubChem CID | 11588811 |
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CAS Registry No. | 449173-19-7 |
ChEMBL Ligand | CHEMBL228102 |
GPCRdb Ligand | VPC23019 |
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Solubility | Solvent:Acidified DMSO (5% 1N HCl in DMSO) , Max Conc. mg/mL: 3.72, Max Conc. mM: 10 with gentle warming; Solvent:2eq. NaOH, Max Conc. mg/mL: 18.62, Max Conc. mM: 50 |
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