MCULE-8801511471
- 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 | 95 USD | N/A | 21 working days | Get Quote |
5 mg | 153 USD | N/A | 21 working days | Get Quote |
10 mg | 157 USD | 95 | 12 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.
-
MCULE-8453668289
- Component type: Main
-
MCULE-5865307920
- Component type: Main
Name | File |
---|---|
SDF | MCULE-8801511471.sdf |
SMILES | MCULE-8801511471.smiles |
Standard InChI | MCULE-8801511471.inchi |
InChIKey | MCULE-8801511471.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-851448313 | AmBeed | On request | N/A | As is | by synthesis |
P-611158382 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-889423918 | FluoroChem | General BB | N/A | As is | in stock |
P-855374095 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
P-505538482 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-875906764 | J&W Pharmlab | In-stock compounds | 98 | As is | in stock |
P-579622459 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
P-864074549 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-856067718 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 1000 mg |
P-33986313 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-502389440 | TimTec | Building Block Collection | 90 | As is | in stock |
P-886926809 | eNovation Chemicals LLC | Building Block on demand | 96 | As is | by synthesis |
P-612852533 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
P-851555617 | AmBeed | On request | N/A | As a main component | by synthesis |
P-864248862 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
P-590921361 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
P-889282816 | FluoroChem | General BB | N/A | As a main component | in stock |
P-675497398 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
P-596581013 | Key Organics | Building Blocks | 95 | As a main component | 1000 mg |
P-524169648 | Key Organics | Building Blocks | 98 | As a main component | 1000 mg |
P-596577360 | Key Organics | Building Blocks | 95 | As a main component | 100 mg |
P-524194423 | Key Organics | Building Blocks | 95 | As a main component | 5 g |
P-615635568 | LabNetwork | In stock | 95 | As a main component | in stock |
P-881171164 | Life Chemicals | Building Blocks - virtual | 95 | As a main component | by synthesis |
P-854778269 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
P-615424257 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 169.171 |
logP | 2.4797 |
H-bond acceptors | 1 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 26.02 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 41.5314 |
Atoms | 21 |
Rings | 2 |
Heavy atoms | 12 |
Hydrogen atoms | 9 |
Heteroatoms | 3 |
N/O atoms | 1 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |