MCULE-3614491496
- 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 | 20 working days | Get Quote |
5 mg | 26 USD | 95 | 20 working days | Get Quote |
10 mg | 26 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-3614491496.sdf |
SMILES | MCULE-3614491496.smiles |
Standard InChI | MCULE-3614491496.inchi |
InChIKey | MCULE-3614491496.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867621945 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875784184 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-595216922 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436465766 | Alinda | Building Blocks | 95 | As is | in stock |
P-851594388 | AmBeed | On request | N/A | As is | by synthesis |
P-489146937 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596994824 | Angene | Building Blocks in stock | 95 | As is | 19.47 g |
P-596343998 | Asinex | General screening catalog | 90 | As is | 204 mg |
P-864087521 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590949086 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-454722732 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-851243657 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861551402 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-861972981 | FluoroChem | General BB | N/A | As is | in stock |
P-505494980 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-563452406 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-615655301 | LabNetwork | In stock | 95 | As is | in stock |
P-14064297 | Life Chemicals | Building Blocks | 95 | As is | 27.507 g |
P-601072701 | Life Chemicals | Screening Compounds | 90 | As is | 27.507 g |
P-852446836 | Matrix Scientific | All | N/A | As is | in stock |
P-854769669 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-620218372 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
P-619998867 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
P-23336381 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-502352815 | TimTec | Building Block Collection | 90 | As is | in stock |
P-888361274 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611485714 | Toronto Research | In stock | 90 | As is | in stock |
P-615416159 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 213.659 |
logP | 2.3356 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 38.33 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 56.8497 |
Atoms | 26 |
Rings | 1 |
Heavy atoms | 14 |
Hydrogen atoms | 12 |
Heteroatoms | 4 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |