MCULE-3556464581
- 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 | 95 | 9 working days | Get Quote |
5 mg | 74 USD | 95 | 9 working days | Get Quote |
10 mg | 98 USD | 98 | 11 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-3556464581.sdf |
SMILES | MCULE-3556464581.smiles |
Standard InChI | MCULE-3556464581.inchi |
InChIKey | MCULE-3556464581.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867639393 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875805421 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-595218525 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893523032 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 464 mg |
P-888731653 | AmBeed | In stock | N/A | As is | in stock |
P-489240059 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-25948838 | AnalytiCon Discovery | Natural screening compounds (70%+) | 70 | As is | 100 mg |
P-881108448 | Angene | Building Blocks in stock | 98 | As is | 20 mg |
P-872728780 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-889772761 | AstaTech | In Stock BBs | 98 | As is | in stock |
P-500416914 | AvaChem Scientific | On demand | 95 | As is | by synthesis |
P-890246430 | BLD pharm | In-stock building blocks | 98 | As is | 10 mg |
P-893238407 | Biosynth | In Stock | 95 | As is | in stock |
P-452656429 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-889029480 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-579476978 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-675219647 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-873242435 | Key Organics | Building Blocks | 97 | As is | 5 mg |
P-854691460 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
P-871067952 | MedKoo | In stock compounds | 95 | As is | in stock |
P-619673261 | Molnova | Stock | 98 | As is | in stock |
P-594273993 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-869177489 | TargetMol | Natural Products | 95 | As is | in stock |
P-892295531 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-892337947 | TargetMol | Screening Compounds - stock amount | 95 | As is | 101 mg |
P-855344031 | Toronto Research | In stock | 90 | As is | in stock |
P-868532268 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 236.220 |
logP | 1.8188 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 57.9 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 61.96 |
Atoms | 29 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 12 |
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 |