Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5151569702
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 | 104 USD | 90 | 30 working days | Get Quote |
| 5 mg | 115 USD | 90 | 30 working days | Get Quote |
| 10 mg | 120 USD | 95 | 25 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.
| Name | File |
|---|---|
| SDF | MCULE-5151569702.sdf |
| SMILES | MCULE-5151569702.smiles |
| Standard InChI | MCULE-5151569702.inchi |
| InChIKey | MCULE-5151569702.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-901220811 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869221753 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893533629 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2 g |
| P-866102722 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | unavailable |
| P-851524806 | AmBeed | On request | N/A | As is | by synthesis |
| P-869395458 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-611029624 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-901430654 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-887167815 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-590338573 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1000 mg |
| P-890216138 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-503150375 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-875907253 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
| P-596570817 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-869377597 | Matrix Scientific | All | N/A | As is | in stock |
| P-854841337 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-859993474 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-12651497 | Specs | Screening Compounds | 90 | As is | 1.317 g |
| P-870513878 | Synthonix | In-stock Building Blocks | 95 | As is | unavailable |
| P-611597723 | Toronto Research | In stock | 90 | As is | in stock |
| P-893967239 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.651 |
| logP | 2.1148 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 67.44 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 45.1427 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 6 |
| 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 |
