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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L287080-10mg | 10mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $250.90 | |
L287080-50mg | 50mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $997.90 |
High affinity NK1antagonist
Synonyms | J-012179 | CS-0028948 | DTXSID30430977 | UNII-E4C3XGZ4U7 | 1-(4-(((2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,3-triazol-5-yl)-N,N-dimethylmethanamine hydrochloride | L 760735 | E4C3XGZ4U7 | 1-[5-[[( |
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Specifications & Purity | Moligand™, ≥99%(HPLC) |
Biochemical and Physiological Mechanisms | High affinity NK1receptor antagonist (IC50= 0.19 nM at human NK1receptors). Selective (>300-fold) over h-NK2and h-NK3receptors. Exhibits anxiolytic and antidepressant-like effects. Orally active. |
Storage Temp | Store at -20°C |
Shipped In | Ice chest + Ice pads |
Grade | Moligand™ |
Action Type | ANTAGONIST |
Mechanism of action | Antagonist of NK 1 receptor |
Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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IUPAC Name | 1-[5-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-2H-triazol-4-yl]-N,N-dimethylmethanamine;hydrochloride |
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INCHI | InChI=1S/C26H28F7N5O2.ClH/c1-15(17-10-18(25(28,29)30)12-19(11-17)26(31,32)33)40-24-23(16-4-6-20(27)7-5-16)38(8-9-39-24)14-22-21(13-37(2)3)34-36-35-22;/h4-7,10-12,15,23-24H,8-9,13-14H2,1-3H3,(H,34,35,36);1H/t15-,23+,24-;/m1./s1 |
InChi Key | VZBKOBSSEVXFNF-QIRDZIKRSA-N |
Canonical SMILES | CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)CC3=NNN=C3CN(C)C)C4=CC=C(C=C4)F.Cl |
Isomeric SMILES | C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)CC3=NNN=C3CN(C)C)C4=CC=C(C=C4)F.Cl |
PubChem CID | 9809076 |
Molecular Weight | 611.98 |
PubChem CID | 9809077 |
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CAS Registry No. | 188923-01-5 |
RCSB PDB Ligand | L76 |
GPCRdb Ligand | L760735 |
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Solubility | Solvent:water, Max Conc. mg/mL: 18.36, Max Conc. mM: 30; Solvent:DMSO, Max Conc. mg/mL: 30.6, Max Conc. mM: 50 |
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