MCULE-3441100909
- 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 | 19 working days | Get Quote |
5 mg | 45 USD | 90 | 22 working days | Get Quote |
10 mg | 60 USD | 90 | 22 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-3441100909.sdf |
SMILES | MCULE-3441100909.smiles |
Standard InChI | MCULE-3441100909.inchi |
InChIKey | MCULE-3441100909.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-892861407 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
P-890154150 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-874614139 | AK Scientific | Building Blocks | 99 | As is | in stock |
P-893606697 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 33.9 g |
P-878260720 | AmBeed | In stock | N/A | As is | in stock |
P-868830057 | Angene | Building Blocks in stock | 97 | As is | 33.4 g |
P-872725308 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-889788576 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-878234488 | BLD pharm | In-stock building blocks | 97 | As is | 10.72 g |
P-7510338 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-5990792 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
P-286488 | Chemical Block | Screening Library | 90 | As is | 294 mg |
P-887323131 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34713893 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-888622015 | Key Organics | Building Blocks | 95 | As is | 1 mg |
P-14150763 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
P-895181562 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-871076368 | MedKoo | In stock compounds | 95 | As is | in stock |
P-888174083 | Molnova | On demand | 98 | As is | by synthesis |
P-629661396 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-24056619 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491318993 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-869128981 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892291761 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888641468 | TargetMol | Screening Compounds - stock amount | 95 | As is | 986 mg |
P-22612708 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-855067067 | Toronto Research | In stock | 90 | As is | in stock |
P-1824669 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 152 mg |
P-868529425 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 296.295 |
logP | 3.197 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 61.96 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 80.7469 |
Atoms | 35 |
Rings | 3 |
Heavy atoms | 22 |
Hydrogen atoms | 13 |
Heteroatoms | 5 |
N/O atoms | 4 |
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 |