MCULE-4732624496-0
- 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 | 6 USD | N/A | 14 working days | Get Quote |
5 mg | 6 USD | N/A | 14 working days | Get Quote |
10 mg | 6 USD | N/A | 14 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-3632531025-1
- Component type: Main
-
1
MCULE-3833394421-0
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-4732624496-0.sdf |
SMILES | MCULE-4732624496-0.smiles |
Standard InChI | MCULE-4732624496-0.inchi |
InChIKey | MCULE-4732624496-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-901289043 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-875749404 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-616223614 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-903079968 | Aaron Chemicals LLC | Predominantly Building Block | N/A | As is | 24 kg |
P-851944106 | AmBeed | In stock | N/A | As is | in stock |
P-619179943 | Angene | Building Blocks in stock | N/A | As is | 150 g |
P-864166874 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-619331687 | ChemDiv | Discovery Chemistry Library | 90 | As is | 717 mg |
P-617187594 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
P-868564257 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-861398751 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-862029886 | FluoroChem | General BB | N/A | As is | in stock |
P-675211393 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-890849633 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-617979563 | InterBioScreen | Screening Compounds | 95 | As is | 300 mg |
P-855912762 | Key Organics | Building Blocks | 97 | As is | 100 g |
P-852466317 | Matrix Scientific | All | N/A | As is | in stock |
P-864656959 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-869124976 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-888638649 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
P-903769200 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
---|---|
Components | 2 |
Mass | 205.168 |
logP | 1.0824 |
H-bond acceptors | 4 |
H-bond donors | 0 |
Rotatable bonds | 0 |
PSA | 77.94 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 44.2215 |
Atoms | 17 |
Rings | 2 |
Heavy atoms | 13 |
Hydrogen atoms | 4 |
Heteroatoms | 6 |
N/O atoms | 4 |
Inorganic atoms | 1 |
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 |