MCULE-6658789969
- 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 | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 35 USD | 90 | 17 working days | Get Quote |
10 mg | 41 USD | 90 | 17 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.
-
MCULE-6461573487
- Component type: Main
-
MCULE-5595376129
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6658789969.sdf |
SMILES | MCULE-6658789969.smiles |
Standard InChI | MCULE-6658789969.inchi |
InChIKey | MCULE-6658789969.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886655357 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-901286956 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869338470 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436452067 | Alinda | Building Blocks | 95 | As is | in stock |
P-19909026 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-892510466 | AmBeed | In stock | N/A | As is | in stock |
P-895104112 | Angene | Building Blocks in stock | 97 | As is | 5 g |
P-596261124 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-596485976 | Asinex | General bb catalog | 90 | As is | 1000 mg |
P-896024763 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-893280963 | BLD pharm | In-stock building blocks | 97 | As is | 3.4 g |
P-454702504 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-861536715 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-862063311 | FluoroChem | General BB | N/A | As is | in stock |
P-862262900 | KISHIDA CHEMICAL | K-BB | 95 | As is | 990 mg |
P-579469791 | Key Organics | Building Blocks | 95 | As is | 250 mg |
P-613279812 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-852402939 | Matrix Scientific | All | N/A | As is | in stock |
P-854871672 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-502358600 | TimTec | Building Block Collection | 90 | As is | in stock |
P-23046839 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611588955 | Toronto Research | In stock | 90 | As is | in stock |
P-893727476 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-886840485 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
P-886427941 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
P-890111501 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
P-889842308 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
P-601055448 | Life Chemicals | Screening Compounds | 90 | As a main component | 127 mg |
P-893742816 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 192.261 |
logP | 0.8968 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 41.05 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 63.3227 |
Atoms | 30 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 16 |
Heteroatoms | 4 |
N/O atoms | 4 |
Inorganic atoms | 0 |
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 |