MCULE-7796047447
- 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 | 35 USD | 90 | 19 working days | Get Quote |
5 mg | 35 USD | 90 | 17 working days | Get Quote |
10 mg | 41 USD | 90 | 17 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.
-
MCULE-8890261284
- Component type: Unknown
Name | File |
---|---|
SDF | MCULE-7796047447.sdf |
SMILES | MCULE-7796047447.smiles |
Standard InChI | MCULE-7796047447.inchi |
InChIKey | MCULE-7796047447.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-860630608 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-613850065 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-34893778 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851436851 | AmBeed | On request | N/A | As is | by synthesis |
P-590746525 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-666899680 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 10 mg |
P-454721763 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-449231142 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
P-889379910 | FluoroChem | General BB | 95 | As is | in stock |
P-488551126 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-13765486 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-596586810 | Key Organics | Building Blocks | 90 | As is | 500 mg |
P-852446552 | Matrix Scientific | All | N/A | As is | in stock |
P-864015782 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-454369329 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-13960339 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-519900404 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491194408 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-888579896 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611594705 | Toronto Research | In stock | 90 | As is | in stock |
P-3221196 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.015 g |
P-1853527 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.015 g |
Property | Value |
---|---|
Components | 1 |
Mass | 202.205 |
logP | 2.5686 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 50.44 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 55.1203 |
Atoms | 25 |
Rings | 2 |
Heavy atoms | 15 |
Hydrogen atoms | 10 |
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 |