MCULE-1321347606
- 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 | 19 USD | 92 | 18 working days | Get Quote |
5 mg | 29 USD | 92 | 18 working days | Get Quote |
10 mg | 36 USD | 92 | 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-1321347606.sdf |
SMILES | MCULE-1321347606.smiles |
Standard InChI | MCULE-1321347606.inchi |
InChIKey | MCULE-1321347606.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867315947 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-901287180 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-894657394 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-620803890 | Alinda | Building Blocks | 95 | As is | 4 g |
P-675033957 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851638804 | AmBeed | On request | N/A | As is | by synthesis |
P-901358872 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-590873888 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-674290869 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-674268802 | ChemDiv | Discovery Chemistry Library | 90 | As is | 59 mg |
P-868635007 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-579804603 | Eximed | In-stock screening compounds | 90 | As is | 8.42 g |
P-580089695 | Eximed | Building Block Catalog | 95 | As is | 8.42 g |
P-870568477 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-675509015 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-488548514 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-13639397 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-596595810 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
P-852433224 | Matrix Scientific | All | N/A | As is | in stock |
P-854886804 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-620216369 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 11.42 g |
P-674796602 | Otava | In-House Stock Library | 90 | As is | 11.42 g |
P-454371366 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-13747590 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-856072883 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 11.42 g |
P-675091303 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-855310619 | Toronto Research | In stock | 90 | As is | in stock |
P-852026364 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 7 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 345.842 |
logP | 4.5152 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 6 |
PSA | 91.85 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 85.2015 |
Atoms | 42 |
Rings | 2 |
Heavy atoms | 22 |
Hydrogen atoms | 20 |
Heteroatoms | 7 |
N/O atoms | 5 |
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 |