MCULE-8656146963
- 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 | 8 USD | 95 | 20 working days | Get Quote |
5 mg | 8 USD | 95 | 20 working days | Get Quote |
10 mg | 8 USD | 95 | 20 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-8656146963.sdf |
SMILES | MCULE-8656146963.smiles |
Standard InChI | MCULE-8656146963.inchi |
InChIKey | MCULE-8656146963.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867641207 | A2B Chem | Predominantly Building Block in stock | 90 | As is | in stock |
P-875807319 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869223784 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893588304 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.444 kg |
P-517098551 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-596933310 | Angene | Building Blocks in stock | 95 | As is | 400 g |
P-864177570 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-890243302 | BLD pharm | In-stock building blocks | 97 | As is | 100 g |
P-58638 | Chemical Block | Screening Library | 90 | As is | 6 mg |
P-868618662 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-596564832 | Key Organics | Building Blocks | 95 | As is | 100 mg |
P-856020485 | LaboTest | Screening Collection | 90 | As is | 10 g |
P-854924759 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-888843186 | PharmaBlock | On demand | N/A | As is | by synthesis |
P-868129921 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-888438543 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-2215834 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 6 mg |
P-615411249 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 268.310 |
logP | 2.6282 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 7 |
PSA | 58.2 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 76.7624 |
Atoms | 36 |
Rings | 2 |
Heavy atoms | 20 |
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 |