MCULE-4193515180
- 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 | 34 USD | 90 | 23 working days | Get Quote |
5 mg | 55 USD | 90 | 23 working days | Get Quote |
10 mg | 68 USD | 90 | 23 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-4193515180.sdf |
SMILES | MCULE-4193515180.smiles |
Standard InChI | MCULE-4193515180.inchi |
InChIKey | MCULE-4193515180.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886571239 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-890148177 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-612939797 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436477154 | Alinda | Building Blocks | 95 | As is | in stock |
P-851459909 | AmBeed | On request | N/A | As is | by synthesis |
P-596384662 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-596490616 | Asinex | General bb catalog | 90 | As is | 1000 mg |
P-889817641 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-590815762 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-577168112 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
P-577210971 | ChemDiv | Discovery Chemistry Library | 90 | As is | 61 mg |
P-868647383 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-492272844 | Eximed | Building Block Catalog | 95 | As is | 11.19 g |
P-428624638 | Eximed | In-stock screening compounds | 90 | As is | 11.19 g |
P-580039799 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-492246414 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-855979213 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-852382284 | Matrix Scientific | All | N/A | As is | in stock |
P-854842787 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-34031041 | Otava | In-House Stock Library | 90 | As is | 16.19 g |
P-492280259 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 16.19 g |
P-856065543 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 16.29 g |
P-520132714 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-902564358 | Specs | Natural Products | 80 | As is | 15 mg |
P-896079689 | Specs | Repurposed Compounds | N/A | As is | 15 mg |
P-502390265 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22527095 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 8 mg |
P-611443864 | Toronto Research | In stock | 90 | As is | in stock |
P-893839216 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 215.247 |
logP | 2.8038 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 50.19 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 63.4413 |
Atoms | 29 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 13 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |