MCULE-2424131940-0
- 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 | 8 USD | N/A | 9 working days | Get Quote |
5 mg | 8 USD | N/A | 9 working days | Get Quote |
10 mg | 8 USD | N/A | 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.
Name | File |
---|---|
SDF | MCULE-2424131940-0.sdf |
SMILES | MCULE-2424131940-0.smiles |
Standard InChI | MCULE-2424131940-0.inchi |
InChIKey | MCULE-2424131940-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867661736 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875830733 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590415942 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-851938672 | AmBeed | In stock | N/A | As is | in stock |
P-865926576 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
P-864198111 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-448715589 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
P-868612815 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-862129852 | FluoroChem | General BB | 95 | As is | in stock |
P-488550866 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-855988268 | Key Organics | Building Blocks | 97 | As is | 25 g |
P-31166738 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-525223031 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-601073472 | Life Chemicals | Screening Compounds | 90 | As is | 215 mg |
P-852505285 | Matrix Scientific | All | N/A | As is | in stock |
P-854829126 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-12331288 | Otava | In-House Stock Library | 90 | As is | 710 mg |
P-454369129 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-18829647 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-885546180 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-855247079 | Toronto Research | In stock | 90 | As is | in stock |
P-3245318 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 184 mg |
P-886892767 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 240.257 |
logP | 2.4098 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 58.2 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.7814 |
Atoms | 30 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 12 |
Heteroatoms | 4 |
N/O atoms | 4 |
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 |