Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3071418769
Compound
Show structures
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 | 36 USD | 90 | 17 working days | Get Quote |
| 5 mg | 36 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-5820319174
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3071418769.sdf |
| SMILES | MCULE-3071418769.smiles |
| Standard InChI | MCULE-3071418769.inchi |
| InChIKey | MCULE-3071418769.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893089460 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-580295970 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-502566427 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-856013621 | LaboTest | Screening Collection | 90 | As is | 1000 mg |
| P-856970125 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-875265838 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 5 mg |
| P-892855038 | A2B Chem | Predominantly Building Block in stock | 97 | As a main component | in stock |
| P-890144913 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-615718783 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-893533626 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 206 g |
| P-617324615 | Alinda | Stock Screening Compounds | 90 | As a main component | in stock |
| P-851534280 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-579787439 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-864216166 | AstaTech | Backordered BBs | 97 | As a main component | by synthesis |
| P-590968665 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-619280665 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 0 mg |
| P-868646568 | Combi-Blocks | Building Block in stock | 97 | As a main component | in stock |
| P-580304978 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-505526994 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| P-855908917 | Key Organics | Building Blocks | 95 | As a main component | 5.175 g |
| P-856004947 | Key Organics | Screening Compounds and Fragments | 95 | As a main component | 5.175 g |
| P-579637527 | LabSeeker, Inc | On demand Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-888666552 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-870512555 | Synthonix | In-stock Building Blocks | 97 | As a main component | 100 g |
| P-33227251 | TimTec | ActiMol 2 Week | 90 | As a main component | in stock |
| P-617768244 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 15 mg |
| P-615392437 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 191.269 |
| logP | 2.1294 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 20.31 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.9195 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 17 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
