MCULE-8361592943
- 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 | 46 USD | 95 | 21 working days | Get Quote |
5 mg | 46 USD | 95 | 21 working days | Get Quote |
10 mg | 54 USD | 95 | 21 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.
Name | File |
---|---|
SDF | MCULE-8361592943.sdf |
SMILES | MCULE-8361592943.smiles |
Standard InChI | MCULE-8361592943.inchi |
InChIKey | MCULE-8361592943.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852113679 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889938498 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-436463805 | Alinda | Building Blocks | 95 | As is | 6 g |
P-851667927 | AmBeed | On request | N/A | As is | by synthesis |
P-901359586 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-591000841 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-3844718 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-577155699 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
P-15155072 | ChemDiv | Discovery Chemistry Library | 90 | As is | 35 mg |
P-343288 | Chemical Block | Screening Library | 90 | As is | 441 mg |
P-861524080 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34730412 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-502485161 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-504467732 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-502863667 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-492227916 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-596586707 | Key Organics | Building Blocks | 90 | As is | 500 mg |
P-588253067 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852434299 | Matrix Scientific | All | N/A | As is | in stock |
P-895669264 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-19524860 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-579451023 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-885516327 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-33452389 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502387818 | TimTec | Building Block Collection | 90 | As is | in stock |
P-855310866 | Toronto Research | In stock | 90 | As is | in stock |
P-1228037 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.149 g |
P-464662504 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.149 g |
P-578073727 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.004 g |
Property | Value |
---|---|
Components | 1 |
Mass | 208.260 |
logP | 1.2346 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 75.01 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 63.5181 |
Atoms | 31 |
Rings | 2 |
Heavy atoms | 15 |
Hydrogen atoms | 16 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |