MCULE-6555960233
- 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 | 30 USD | 98 | 16 working days | Get Quote |
5 mg | 43 USD | 98 | 16 working days | Get Quote |
10 mg | 63 USD | 98 | 16 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-6555960233.sdf |
SMILES | MCULE-6555960233.smiles |
Standard InChI | MCULE-6555960233.inchi |
InChIKey | MCULE-6555960233.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867549919 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875707567 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-903033246 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 300 mg |
P-893514434 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 500 mg |
P-489181219 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596982030 | Angene | Building Blocks in stock | 98 | As is | 300 mg |
P-872722560 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-904969468 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-868544057 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
P-893257204 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-851283806 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-860799150 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
P-580450600 | CliniSciences S.A.S | All products | 98 | As is | in stock |
P-579480557 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-852459420 | Matrix Scientific | All | N/A | As is | in stock |
P-474024168 | MedKoo | In stock compounds | 95 | As is | in stock |
P-608272758 | Molnova | Stock | 98 | As is | in stock |
P-885540002 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-869117758 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892288649 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888632918 | TargetMol | Screening Compounds - stock amount | 95 | As is | 151 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 504.360 |
logP | 4.064 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 6 |
PSA | 43.7 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 127.0665 |
Atoms | 54 |
Rings | 4 |
Heavy atoms | 29 |
Hydrogen atoms | 25 |
Heteroatoms | 6 |
N/O atoms | 5 |
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 |