MCULE-2469866903
- 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 | 44 USD | 95 | 7 working days | Get Quote |
5 mg | 79 USD | 90 | 21 working days | Get Quote |
10 mg | 94 USD | 90 | 21 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-2469866903.sdf |
SMILES | MCULE-2469866903.smiles |
Standard InChI | MCULE-2469866903.inchi |
InChIKey | MCULE-2469866903.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886578872 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-901261651 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869290156 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-903100943 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 100 mg |
P-893606459 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 201 mg |
P-872726177 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-889521158 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-893245403 | Biosynth | In Stock | 95 | As is | in stock |
P-851241330 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-878212365 | Key Organics | Building Blocks | 95 | As is | 5 mg |
P-852520180 | Matrix Scientific | All | N/A | As is | in stock |
P-904060786 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
P-874452587 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
P-584615052 | MedKoo | In stock compounds | 95 | As is | in stock |
P-517338192 | Otava | In-House Stock Library | 90 | As is | 251 mg |
P-892228911 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-869176039 | TargetMol | Natural Products | 95 | As is | in stock |
P-892291191 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-892322235 | TargetMol | Screening Compounds - stock amount | 95 | As is | 100 mg |
P-611518472 | Toronto Research | In stock | 90 | As is | in stock |
P-893969939 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 325.319 |
logP | 3.5951 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 0 |
PSA | 81.51 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 100.7501 |
Atoms | 36 |
Rings | 6 |
Heavy atoms | 25 |
Hydrogen atoms | 11 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |