MCULE-2330108857
- 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 | 33 USD | 90 | 23 working days | Get Quote |
5 mg | 35 USD | 95 | 14 working days | Get Quote |
10 mg | 41 USD | 95 | 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.
Name | File |
---|---|
SDF | MCULE-2330108857.sdf |
SMILES | MCULE-2330108857.smiles |
Standard InChI | MCULE-2330108857.inchi |
InChIKey | MCULE-2330108857.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852138418 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889952373 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-894641276 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436462224 | Alinda | Building Blocks | 95 | As is | 1000 mg |
P-851488747 | AmBeed | On request | N/A | As is | by synthesis |
P-590770530 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-3985769 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-454713620 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-861532144 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-428587923 | Eximed | In-stock screening compounds | 90 | As is | 1.32 g |
P-492272432 | Eximed | Building Block Catalog | 95 | As is | 1.32 g |
P-492246205 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-502966932 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-502474146 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-855974326 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-852433121 | Matrix Scientific | All | N/A | As is | in stock |
P-854893584 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-674921238 | Otava | In-House Stock Library | 90 | As is | 1.32 g |
P-620233510 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.32 g |
P-856067474 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 1.32 g |
P-19518656 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-855310562 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 309.339 |
logP | 2.8425 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 106.12 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 78.9513 |
Atoms | 36 |
Rings | 2 |
Heavy atoms | 21 |
Hydrogen atoms | 15 |
Heteroatoms | 7 |
N/O atoms | 6 |
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 |