MCULE-6738546583-0
- 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 | 70 USD | 90 | 22 working days | Get Quote |
5 mg | 102 USD | 90 | 22 working days | Get Quote |
10 mg | 130 USD | 90 | 27 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-7394371884-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6738546583-0.sdf |
SMILES | MCULE-6738546583-0.smiles |
Standard InChI | MCULE-6738546583-0.inchi |
InChIKey | MCULE-6738546583-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596486565 | Asinex | General bb catalog | 90 | As is | unavailable |
P-3848368 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-19550376 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-893765934 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-893470209 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 3.194 g |
P-851737846 | AmBeed | On request | N/A | As a main component | by synthesis |
P-892488780 | Asinex | General screening catalog | 90 | As a main component | 1000 mg |
P-590923267 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
P-868548824 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
P-862112246 | FluoroChem | General BB | 95 | As a main component | in stock |
P-675492662 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
P-675404034 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
P-852403482 | Matrix Scientific | All | N/A | As a main component | in stock |
P-895262028 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
P-873218530 | TimTec | Building Block Collection | 90 | As a main component | in stock |
P-855252378 | Toronto Research | In stock | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 191.205 |
logP | 2.6876 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 54.7 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 53.3521 |
Atoms | 24 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 10 |
Heteroatoms | 4 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |