MCULE-2756525643
- 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 | 65 USD | 97 | 15 working days | Get Quote |
5 mg | 65 USD | 97 | 15 working days | Get Quote |
10 mg | 65 USD | 97 | 15 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-2756525643.sdf |
SMILES | MCULE-2756525643.smiles |
Standard InChI | MCULE-2756525643.inchi |
InChIKey | MCULE-2756525643.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-872830544 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-901271649 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-613847736 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-893446755 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 15.203 g |
P-868839465 | Angene | Building Blocks in stock | 97 | As is | 5 g |
P-866715529 | BLD pharm | In-stock building blocks | 97 | As is | 4.405 g |
P-901435858 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-454690425 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-15159069 | ChemDiv | Discovery Chemistry Library | 90 | As is | 16 mg |
P-436445176 | Chemical Block | Building Blocks | 90 | As is | 5.5 g |
P-359720 | Chemical Block | Screening Library | 90 | As is | 248 mg |
P-851290723 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-887107779 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-34734695 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-862092827 | FluoroChem | General BB | N/A | As is | in stock |
P-502928459 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-492237275 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-500151863 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
P-900152850 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-619569690 | Life Chemicals | Screening Compounds | 90 | As is | 192 mg |
P-854918302 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-888897329 | PharmaBlock | In stock | N/A | As is | in stock |
P-24068646 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33453994 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502359720 | TimTec | Building Block Collection | 90 | As is | in stock |
P-615461173 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 158.196 |
logP | 2.4329 |
H-bond acceptors | 1 |
H-bond donors | 0 |
Rotatable bonds | 1 |
PSA | 17.07 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 49.04 |
Atoms | 22 |
Rings | 2 |
Heavy atoms | 12 |
Hydrogen atoms | 10 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |