MCULE-5261994676-1
- 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 | 39 USD | 95 | 18 working days | Get Quote |
5 mg | 39 USD | 95 | 18 working days | Get Quote |
10 mg | 39 USD | 95 | 18 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-5261994676-1.sdf |
SMILES | MCULE-5261994676-1.smiles |
Standard InChI | MCULE-5261994676-1.inchi |
InChIKey | MCULE-5261994676-1.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867665082 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875833682 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869184394 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505400808 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-580233744 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-617054142 | Allbio Pharm | Backorder | N/A | As is | by resynthesis (? - ? days) |
P-851815126 | AmBeed | On request | N/A | As is | by synthesis |
P-489110317 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-597010659 | Angene | Building Blocks in stock | 97 | As is | 1000 mg |
P-596471822 | Asinex | General screening catalog | 90 | As is | 101 mg |
P-864110503 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-591094021 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-893233789 | Biosynth | In Stock | 95 | As is | in stock |
P-504764994 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-851240955 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-868622990 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-861974796 | FluoroChem | General BB | 95 | As is | in stock |
P-524169675 | Key Organics | Building Blocks | 98 | As is | 100 mg |
P-852520041 | Matrix Scientific | All | N/A | As is | in stock |
P-854784951 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-894587651 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491426490 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-896084410 | Specs | Repurposed Compounds | N/A | As is | 10 mg |
P-502330330 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22497248 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
P-611487066 | Toronto Research | In stock | 90 | As is | in stock |
P-481001130 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 209.224 |
logP | 2.0031 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 87.66 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 53.0713 |
Atoms | 21 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 7 |
Heteroatoms | 5 |
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 |