Details
Stereochemistry | ACHIRAL |
Molecular Formula | C30H32N6 |
Molecular Weight | 476.6153 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3N2)N4CCN(CC5=CC=C6N=CC=NC6=C5)CC4
InChI
InChIKey=AVEVJMZJJJDOCI-UHFFFAOYSA-N
InChI=1S/C30H32N6/c1-30(2,3)23-10-8-22(9-11-23)29-33-25-5-4-6-27(28(25)34-29)36-17-15-35(16-18-36)20-21-7-12-24-26(19-21)32-14-13-31-24/h4-14,19H,15-18,20H2,1-3H3,(H,33,34)
DescriptionSources: https://www.ncbi.nlm.nih.gov/pubmed/19271735Curator's Comment: description was created based on several sources, including:
http://www.google.com.na/patents/US20060211699
Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735
Curator's Comment: description was created based on several sources, including:
http://www.google.com.na/patents/US20060211699
WAY 207024 dihydrochloride has been reported to be a potent and high affinity gonadotrophin releasing hormone receptor (GnRH-R) antagonist. WAY 207024 was assessed in vitro for broad off-target activity (65 receptors and enzymes), including the hERG potassium channel, at 2 µM. Some activity at the histamine H2, nonselective opioid, and neurokinin NK2 receptors was noted. Rats, treated orally with WAY 207024 showed profound suppression of leuteinizing hormone that lasted for up to 24 h.
Originator
Sources: http://www.google.com.na/patents/US20060211699
Curator's Comment: # Wyeth Research
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL1855 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735 |
12.0 nM [IC50] | ||
Target ID: CHEMBL2327 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735 |
330.0 nM [Ki] | ||
Target ID: CHEMBL1941 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735 |
850.0 nM [Ki] |
Conditions
Condition | Modality | Targets | Highest Phase | Product |
---|---|---|---|---|
Sample Use Guides
In Vivo Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735
Rat: 30 mg/kg
Route of Administration:
Oral
In Vitro Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/19271735
WAY-207024 showed moderate liver microsome stability (t1/2 = 16 min) and PAMPA membrane diffusion characteristics (Pe = 0.23 × 10-6 cm/s).
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