Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3113753497
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 | 39 USD | 90 | 19 working days | Get Quote |
| 5 mg | 57 USD | 90 | 19 working days | Get Quote |
| 10 mg | 72 USD | 90 | 19 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-8978917724
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3113753497.sdf |
| SMILES | MCULE-3113753497.smiles |
| Standard InChI | MCULE-3113753497.inchi |
| InChIKey | MCULE-3113753497.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886543765 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890143303 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613852976 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903050183 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 1000 mg |
| P-851565593 | AmBeed | On request | N/A | As is | by synthesis |
| P-889828003 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590810439 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-901487216 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-861557871 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-492219926 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-855932567 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-613332489 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-854917709 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12797252 | Otava | In-House Stock Library | 90 | As is | 51 mg |
| P-19659229 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33964985 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502354487 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855235064 | Toronto Research | In stock | 90 | As is | in stock |
| P-25503712 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 78 mg |
| P-893784985 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-886729948 | A2B Chem | Predominantly Building Block in stock | 96 | As a main component | in stock |
| P-890028165 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
| P-874607082 | AK Scientific | Building Blocks | 97 | As a main component | in stock |
| P-903305399 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As a main component | 2.5 g |
| P-904758404 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-889837992 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-901475753 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-854858684 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-893850508 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 291.349 |
| logP | 1.4148 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 120.53 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.1608 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| 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 |
