MCULE-4267694664
- 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 | 90 | 21 working days | Get Quote |
5 mg | 72 USD | 90 | 21 working days | Get Quote |
10 mg | 86 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-4267694664.sdf |
SMILES | MCULE-4267694664.smiles |
Standard InChI | MCULE-4267694664.inchi |
InChIKey | MCULE-4267694664.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886577947 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889911793 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-853425675 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893614162 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 96.75 g |
P-580253912 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-851863505 | AmBeed | On request | N/A | As is | by synthesis |
P-889816687 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-591020828 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-871217047 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861959523 | FluoroChem | General BB | 95 | As is | in stock |
P-891392812 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-563665513 | Key Organics | Building Blocks | 97 | As is | 50 mg |
P-895635603 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-492278061 | Otava | Chemical Building Blocks for Prompt Delivery | 99 | As is | 1.499 g |
P-12472317 | Otava | In-House Stock Library | 90 | As is | 1.499 g |
P-611572713 | Toronto Research | In stock | 90 | As is | in stock |
P-893858853 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 165.618 |
logP | 2.79618 |
H-bond acceptors | 1 |
H-bond donors | 0 |
Rotatable bonds | 2 |
PSA | 23.79 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 45.781 |
Atoms | 19 |
Rings | 1 |
Heavy atoms | 11 |
Hydrogen atoms | 8 |
Heteroatoms | 2 |
N/O atoms | 1 |
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 |