MCULE-3378984503
- 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 | 98 | 22 working days | Get Quote |
5 mg | 55 USD | 98 | 22 working days | Get Quote |
10 mg | 95 USD | 98 | 22 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-3378984503.sdf |
SMILES | MCULE-3378984503.smiles |
Standard InChI | MCULE-3378984503.inchi |
InChIKey | MCULE-3378984503.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-892858789 | A2B Chem | Predominantly Building Block in stock | 10 | As is | in stock |
P-890150784 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-893606564 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 850 mg |
P-901179433 | AmBeed | In stock | N/A | As is | in stock |
P-875889838 | Angene | Building Blocks in stock | 99 | As is | 400 mg |
P-872726373 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-889521951 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-901536930 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-887324365 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-868659970 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-854622097 | Excenen | Excenen compounds | 98 | As is | in stock |
P-873244782 | Key Organics | Building Blocks | 95 | As is | 5 mg |
P-854718760 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-474020437 | MedKoo | In stock compounds | 95 | As is | in stock |
P-888173984 | Molnova | On demand | 98 | As is | by synthesis |
P-869127402 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892291468 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888640520 | TargetMol | Screening Compounds - stock amount | 95 | As is | 195 mg |
P-868508242 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 355.184 |
logP | 3.5584 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 54.6 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 95.5117 |
Atoms | 33 |
Rings | 4 |
Heavy atoms | 22 |
Hydrogen atoms | 11 |
Heteroatoms | 5 |
N/O atoms | 4 |
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 |