MCULE-7688480775
- 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 | 34 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.
Name | File |
---|---|
SDF | MCULE-7688480775.sdf |
SMILES | MCULE-7688480775.smiles |
Standard InChI | MCULE-7688480775.inchi |
InChIKey | MCULE-7688480775.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852117611 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889943034 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-894628448 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-516963005 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-436474582 | Alinda | Building Blocks | 95 | As is | in stock |
P-851398903 | AmBeed | On request | N/A | As is | by synthesis |
P-590739151 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-454690521 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-15159244 | ChemDiv | Discovery Chemistry Library | 90 | As is | 16 mg |
P-436445214 | Chemical Block | Building Blocks | 90 | As is | 9.68 g |
P-360650 | Chemical Block | Screening Library | 90 | As is | 282 mg |
P-861524869 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34734904 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-855978346 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-852534334 | Matrix Scientific | All | N/A | As is | in stock |
P-854922879 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-519875660 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491121346 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-502374941 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22531031 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 80 mg |
P-855349401 | Toronto Research | In stock | 90 | As is | in stock |
P-424751320 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 55 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 241.197 |
logP | 1.9218 |
H-bond acceptors | 7 |
H-bond donors | 0 |
Rotatable bonds | 5 |
PSA | 90.58 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 59.5275 |
Atoms | 28 |
Rings | 1 |
Heavy atoms | 17 |
Hydrogen atoms | 11 |
Heteroatoms | 7 |
N/O atoms | 7 |
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 |