MCULE-9673549026
- 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 | 17 working days | Get Quote |
5 mg | 52 USD | 90 | 17 working days | Get Quote |
10 mg | 67 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.
-
1
MCULE-9749850155
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-9673549026.sdf |
SMILES | MCULE-9673549026.smiles |
Standard InChI | MCULE-9673549026.inchi |
InChIKey | MCULE-9673549026.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-872835648 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875843365 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-851624557 | AmBeed | On request | N/A | As is | by synthesis |
P-611087835 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-616226609 | ChemBridge | Building Block Library | 95 | As is | in stock |
P-4149010 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-868570371 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-862058337 | FluoroChem | General BB | N/A | As is | in stock |
P-855950506 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-869022112 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-893680713 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-867494360 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
P-424905758 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
P-35084313 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 75 mg |
Property | Value |
---|---|
Components | 2 |
Mass | 249.134 |
logP | 3.8361 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 4 |
PSA | 55.12 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 65.4316 |
Atoms | 29 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 14 |
Heteroatoms | 5 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |