MCULE-2710906420-0
- 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 | 10 USD | 98 | 20 working days | Get Quote |
5 mg | 10 USD | 98 | 20 working days | Get Quote |
10 mg | 10 USD | 98 | 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-2710906420-0.sdf |
SMILES | MCULE-2710906420-0.smiles |
Standard InChI | MCULE-2710906420-0.inchi |
InChIKey | MCULE-2710906420-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867569168 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875728922 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590359575 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-893512061 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 3.812 kg |
P-436469303 | Alinda | Building Blocks | 95 | As is | in stock |
P-851941924 | AmBeed | In stock | N/A | As is | in stock |
P-489236815 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-865907829 | Angene | Building Blocks in stock | 98 | As is | 522 g |
P-454635706 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-448836096 | ChemDiv | Discovery Chemistry Library | 90 | As is | 34 mg |
P-868607461 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-862030850 | FluoroChem | General BB | 95 | As is | in stock |
P-502471390 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-454415206 | Key Organics | Building Blocks | 90 | As is | 2.806 g |
P-18815971 | Key Organics | Screening Compounds and Fragments | 90 | As is | 2.806 g |
P-31251075 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-852448608 | Matrix Scientific | All | N/A | As is | in stock |
P-895256252 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-885538397 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-590419737 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 156.269 |
logP | 1.8478 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 29.26 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 52.7814 |
Atoms | 31 |
Rings | 1 |
Heavy atoms | 11 |
Hydrogen atoms | 20 |
Heteroatoms | 2 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |