MCULE-7927022902
- 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 | 17 USD | 97 | 20 working days | Get Quote |
5 mg | 17 USD | 97 | 20 working days | Get Quote |
10 mg | 17 USD | 97 | 20 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-7927022902.sdf |
SMILES | MCULE-7927022902.smiles |
Standard InChI | MCULE-7927022902.inchi |
InChIKey | MCULE-7927022902.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-612887093 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-875762209 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869329996 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893572523 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 99.5 g |
P-596960044 | Angene | Building Blocks in stock | 97 | As is | 15 g |
P-866722983 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864162456 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-605420879 | BLD pharm | In-stock building blocks | 97 | As is | 1.35 g |
P-901444267 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-4960907 | ChemDiv | Discovery Chemistry Library | 90 | As is | 4 mg |
P-124613 | Chemical Block | Screening Library | 90 | As is | 10 mg |
P-861553526 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-503087259 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-502614277 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-492214920 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-855908696 | Key Organics | Building Blocks | 95 | As is | 23.018 g |
P-855991939 | Key Organics | Screening Compounds and Fragments | 95 | As is | 23.018 g |
P-31211244 | LaboTest | Screening Collection | 90 | As is | 5 g |
P-35162101 | Maybridge | Screening Collection | 90 | As is | 12.885 kg |
P-868742723 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-19532402 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-889870495 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-23366658 | Specs | Screening Compounds | 90 | As is | 12 mg |
P-896139272 | Specs | Screening Compounds | 90 | As is | 7 mg |
P-902603713 | Specs | Natural Products | 80 | As is | 12 mg |
P-902648443 | Specs | Natural Products | 80 | As is | 7 mg |
P-873218246 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22494759 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 393 mg |
P-667002443 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 236.268 |
logP | 2.3282 |
H-bond acceptors | 3 |
H-bond donors | 0 |
Rotatable bonds | 2 |
PSA | 32.67 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 77.975 |
Atoms | 30 |
Rings | 3 |
Heavy atoms | 18 |
Hydrogen atoms | 12 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |