MCULE-6357309588
- 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 | 35 USD | 90 | 17 working days | Get Quote |
10 mg | 41 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.
Name | File |
---|---|
SDF | MCULE-6357309588.sdf |
SMILES | MCULE-6357309588.smiles |
Standard InChI | MCULE-6357309588.inchi |
InChIKey | MCULE-6357309588.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852082859 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-875763725 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-613848042 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-580216033 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-436456726 | Alinda | Building Blocks | 95 | As is | in stock |
P-34875498 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851562771 | AmBeed | On request | N/A | As is | by synthesis |
P-489224383 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-889842182 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-454705710 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-580393175 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
P-504190854 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-855972997 | Key Organics | Building Blocks | 95 | As is | 500 mg |
P-856014848 | LaboTest | Screening Collection | 90 | As is | 100 mg |
P-613278137 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-580462442 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
P-852429368 | Matrix Scientific | All | N/A | As is | in stock |
P-864018458 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-519826859 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22651168 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502359387 | TimTec | Building Block Collection | 90 | As is | in stock |
P-888467457 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-855221014 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 248.502 |
logP | 2.7464 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 29.1 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 53.6347 |
Atoms | 19 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 7 |
Heteroatoms | 4 |
N/O atoms | 2 |
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 |