MCULE-4767293292
- 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 | 35 USD | 95 | 14 working days | Get Quote |
5 mg | 35 USD | 95 | 14 working days | Get Quote |
10 mg | 41 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-4767293292.sdf |
SMILES | MCULE-4767293292.smiles |
Standard InChI | MCULE-4767293292.inchi |
InChIKey | MCULE-4767293292.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852113642 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889938069 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869204354 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436474591 | Alinda | Building Blocks | 95 | As is | 10 g |
P-612677829 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851809143 | AmBeed | On request | N/A | As is | by synthesis |
P-591128351 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-427950570 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | in stock |
P-454736536 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-893622435 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-862070692 | FluoroChem | General BB | N/A | As is | in stock |
P-855978352 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-852534346 | Matrix Scientific | All | N/A | As is | in stock |
P-854932068 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-502374951 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22532828 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 190 mg |
P-855357875 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 232.347 |
logP | 4.271 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 67.15 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 71.2244 |
Atoms | 32 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 16 |
Heteroatoms | 3 |
N/O atoms | 2 |
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 |