MCULE-8362273883-0
- 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 | 113 USD | 98 | 16 working days | Get Quote |
5 mg | 113 USD | 98 | 16 working days | Get Quote |
10 mg | 115 USD | 99 | 8 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-9099661994-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-8362273883-0.sdf |
SMILES | MCULE-8362273883-0.smiles |
Standard InChI | MCULE-8362273883-0.inchi |
InChIKey | MCULE-8362273883-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867679720 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
P-875857273 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-893606661 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 3.2 g |
P-871256268 | AmBeed | In stock | N/A | As is | in stock |
P-892192706 | Angene | Building Blocks in stock | 97 | As is | 3 g |
P-889578421 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-868543738 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
P-871194759 | BLD pharm | In-stock building blocks | 97 | As is | 1.885 g |
P-901520453 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-580451071 | CliniSciences S.A.S | All products | 98 | As is | in stock |
P-893626200 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-580424532 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-888621986 | Key Organics | Building Blocks | 95 | As is | 1 mg |
P-895188457 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
P-871073999 | MedKoo | In stock compounds | 95 | As is | in stock |
P-878644269 | Molnova | Stock | 98 | As is | in stock |
P-892291686 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-855066677 | Toronto Research | In stock | 90 | As is | in stock |
P-894006652 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
P-852183196 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
P-855052467 | Toronto Research | In stock | 90 | Main component | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 236.739 |
logP | 2.9973 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 0 |
PSA | 16.96 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 74.3137 |
Atoms | 33 |
Rings | 3 |
Heavy atoms | 16 |
Hydrogen atoms | 17 |
Heteroatoms | 3 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |