MCULE-7578106338
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 13 USD | 98 | 11 working days | Get Quote |
5 mg | 13 USD | 98 | 11 working days | Get Quote |
10 mg | 13 USD | 98 | 11 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
1
MCULE-5470001667
- Component type: Main
-
1
MCULE-3743781291
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-7578106338.sdf |
SMILES | MCULE-7578106338.smiles |
Standard InChI | MCULE-7578106338.inchi |
InChIKey | MCULE-7578106338.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-579693878 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
P-867566821 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
P-875727138 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
P-597027883 | AEchem | Building blocks | 98 | Main component | in stock |
P-869195782 | AK Scientific | Building Blocks | 95 | Main component | in stock |
P-505392034 | AK Scientific | Building Blocks | 98 | Main component | in stock |
P-864122392 | AstaTech | In Stock BBs | 98 | Main component | in stock |
P-893261713 | Biosynth | Synthesis | 95 | Main component | by synthesis |
P-868559961 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
P-580427093 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
P-870658727 | Glentham Life Sciences | Compounds typically in stock | 97 | Main component | in stock |
P-505517895 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
P-580514918 | Manchester Organics | Stock compounds | 98 | Main component | 550 g |
P-852467865 | Matrix Scientific | All | N/A | Main component | in stock |
P-863719485 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
P-584626893 | MedKoo | In stock compounds | 95 | Main component | in stock |
P-878646991 | Molnova | Stock | 98 | Main component | in stock |
P-500381276 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
P-885546903 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
P-869125113 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
P-892290615 | TargetMol | In Stock BB | 95 | Main component | unavailable |
P-888638760 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 14.935 g |
P-575293892 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 502.316 |
logP | 4.6828 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 3 |
PSA | 57.53 |
RO5 violations | 1 |
RO3 violations | 2 |
Refractivity | 86.4876 |
Atoms | 40 |
Rings | 3 |
Heavy atoms | 23 |
Hydrogen atoms | 17 |
Heteroatoms | 4 |
N/O atoms | 3 |
Inorganic atoms | 1 |
Halogen atoms | 0 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |