MCULE-6259795554
- 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 | 36 USD | 98 | 16 working days | Get Quote |
5 mg | 40 USD | 95 | 9 working days | Get Quote |
10 mg | 64 USD | 95 | 9 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.
-
MCULE-2073592931
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6259795554.sdf |
SMILES | MCULE-6259795554.smiles |
Standard InChI | MCULE-6259795554.inchi |
InChIKey | MCULE-6259795554.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867668273 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875840523 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-892792195 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893610349 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 3.25 g |
P-851946041 | AmBeed | In stock | N/A | As is | in stock |
P-865928093 | Angene | Building Blocks in stock | 98 | As is | 750 mg |
P-889574794 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-887195014 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-454400536 | Key Organics | Building Blocks | 90 | As is | 491 mg |
P-18759509 | Key Organics | Screening Compounds and Fragments | 90 | As is | 491 mg |
P-854719268 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-584619339 | MedKoo | In stock compounds | 95 | As is | in stock |
P-584627025 | MedKoo | In stock compounds | 95 | As is | in stock |
P-878644927 | Molnova | Stock | 98 | As is | in stock |
P-869164277 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892300304 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888659490 | TargetMol | Screening Compounds - stock amount | 95 | As is | 201 mg |
P-611492717 | Toronto Research | In stock | 90 | As is | in stock |
P-868526374 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
P-4406221 | ChemBridge | EXPRESS-Pick Collection | 85 | As a main component | 25 mg |
P-619831199 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 3 mg |
P-675101826 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 270.326 |
logP | 4.7658 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 53.16 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 77.0517 |
Atoms | 30 |
Rings | 3 |
Heavy atoms | 19 |
Hydrogen atoms | 11 |
Heteroatoms | 4 |
N/O atoms | 2 |
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 |