MCULE-7951276168
- 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 | 26 USD | 95 | 14 working days | Get Quote |
5 mg | 26 USD | 95 | 14 working days | Get Quote |
10 mg | 26 USD | 95 | 14 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-7951276168.sdf |
SMILES | MCULE-7951276168.smiles |
Standard InChI | MCULE-7951276168.inchi |
InChIKey | MCULE-7951276168.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867578869 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875738064 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869205403 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893597495 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.41 g |
P-851451365 | AmBeed | On request | N/A | As is | by synthesis |
P-888815043 | Angene | Building Blocks in stock | 98 | As is | 300 mg |
P-889849387 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-590757208 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-893237944 | Biosynth | In Stock | 95 | As is | in stock |
P-881633291 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-851335512 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861340948 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-873242893 | Key Organics | Building Blocks | 97 | As is | 50 mg |
P-31258538 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-869096091 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-892304934 | TargetMol | Natural Products | 95 | As is | in stock |
P-869165419 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-888660249 | TargetMol | Screening Compounds - stock amount | 95 | As is | 355 mg |
P-22536562 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 99 mg |
P-611369935 | Toronto Research | In stock | 90 | As is | in stock |
P-611527777 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 270.236 |
logP | 2.5768 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 1 |
PSA | 90.9 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 73.989 |
Atoms | 30 |
Rings | 3 |
Heavy atoms | 20 |
Hydrogen atoms | 10 |
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 |