MCULE-1932096466
- 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 | 156 USD | 98 | 11 working days | Get Quote |
5 mg | 156 USD | 98 | 11 working days | Get Quote |
10 mg | 156 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-1932096466.sdf |
SMILES | MCULE-1932096466.smiles |
Standard InChI | MCULE-1932096466.inchi |
InChIKey | MCULE-1932096466.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867624261 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
P-875787052 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-853433542 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-851592153 | AmBeed | On request | N/A | As is | by synthesis |
P-864244205 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-500414769 | AvaChem Scientific | All products | 98 | As is | by synthesis |
P-590969593 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-578049855 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-887203020 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-675218871 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-873242731 | Key Organics | Building Blocks | 97 | As is | 1 mg |
P-854691444 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
P-878644850 | Molnova | Stock | 98 | As is | in stock |
P-869178981 | TargetMol | Natural Products | 95 | As is | 300 mg |
P-611516548 | Toronto Research | In stock | 90 | As is | in stock |
P-855061100 | Toronto Research | In stock | 90 | As is | in stock |
P-868540678 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 260.198 |
logP | 1.7686 |
H-bond acceptors | 6 |
H-bond donors | 4 |
Rotatable bonds | 0 |
PSA | 111.13 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 68.082 |
Atoms | 27 |
Rings | 3 |
Heavy atoms | 19 |
Hydrogen atoms | 8 |
Heteroatoms | 6 |
N/O atoms | 6 |
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 |