MCULE-8975252119
- 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 | 45 USD | 90 | 23 working days | Get Quote |
5 mg | 68 USD | 97 | 20 working days | Get Quote |
10 mg | 68 USD | 97 | 20 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-8975252119.sdf |
SMILES | MCULE-8975252119.smiles |
Standard InChI | MCULE-8975252119.inchi |
InChIKey | MCULE-8975252119.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867555216 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-867624125 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875714206 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-875786374 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-874641243 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-869302739 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-867709072 | AmBeed | In stock | N/A | As is | in stock |
P-851633741 | AmBeed | On request | N/A | As is | by synthesis |
P-489127999 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-865918215 | Angene | Building Blocks in stock | 97 | As is | 14.75 g |
P-494412086 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864085686 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-494301997 | BioBlocks | Bioblocks Building Blocks | 95 | As is | in stock |
P-868648667 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-861964134 | FluoroChem | General BB | N/A | As is | in stock |
P-505529168 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-502569575 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-563403448 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
P-854809793 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-12933915 | Otava | In-House Stock Library | 90 | As is | 1.039 g |
P-492285248 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.039 g |
P-885533094 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-502339436 | TimTec | Building Block Collection | 90 | As is | in stock |
P-855222216 | Toronto Research | In stock | 90 | As is | in stock |
P-855222227 | Toronto Research | In stock | 90 | As is | in stock |
P-480892994 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
P-868535342 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 251.279 |
logP | 3.2037 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 42.09 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 76.4967 |
Atoms | 32 |
Rings | 3 |
Heavy atoms | 19 |
Hydrogen atoms | 13 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |