Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1410741168
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 9 USD | 98 | 14 working days | Get Quote |
| 5 mg | 9 USD | 98 | 14 working days | Get Quote |
| 10 mg | 9 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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.
-
MCULE-5895765584
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1410741168.sdf |
| SMILES | MCULE-1410741168.smiles |
| Standard InChI | MCULE-1410741168.inchi |
| InChIKey | MCULE-1410741168.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867552263 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
| P-875710290 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597021657 | AEchem | Building blocks | 95 | As is | in stock |
| P-597019108 | AEchem | Building blocks | 95 | As is | in stock |
| P-590367353 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-903035725 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 50 g |
| P-610975711 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 688.42 g |
| P-606873998 | AmBeed | In stock | N/A | As is | in stock |
| P-489177075 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-865905666 | Angene | Building Blocks in stock | 98 | As is | 150 g |
| P-589652591 | Apollo Scientific | In Stock | 95 | As is | 25 g |
| P-864089280 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-666962186 | BLD pharm | In-stock building blocks | 98 | As is | 1.25 g |
| P-494301106 | BioBlocks | In stock | 95 | As is | in stock |
| P-851287351 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868621120 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-861963872 | FluoroChem | General BB | N/A | As is | in stock |
| P-889434804 | FluoroChem | General BB | N/A | As is | in stock |
| P-588714008 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-454388798 | Key Organics | Building Blocks | 95 | As is | 6.235 g |
| P-563472213 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-18789057 | Key Organics | Screening Compounds and Fragments | 95 | As is | 6.235 g |
| P-852456709 | Matrix Scientific | All | N/A | As is | in stock |
| P-855399303 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-889878256 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-520170754 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-611365337 | Toronto Research | In stock | 90 | As is | in stock |
| P-424744962 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 7 mg |
| P-886949028 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-893862664 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| P-893873088 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 233.187 |
| logP | 2.8802 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 50.5032 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
