Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6012470994
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 | 47 USD | 90 | 8 working days | Get Quote |
| 5 mg | 55 USD | 99 | 17 working days | Get Quote |
| 10 mg | 55 USD | 99 | 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.
| Name | File |
|---|---|
| SDF | MCULE-6012470994.sdf |
| SMILES | MCULE-6012470994.smiles |
| Standard InChI | MCULE-6012470994.inchi |
| InChIKey | MCULE-6012470994.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892890409 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-890191647 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-893579901 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 48.512 g |
| P-885355049 | AmBeed | In stock | N/A | As is | in stock |
| P-888833446 | Angene | Building Blocks in stock | 98 | As is | 10 g |
| P-872723659 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-895944583 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-889586174 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-890239389 | BLD pharm | In-stock building blocks | 98 | As is | 2.095 g |
| P-893232807 | Biosynth | In Stock | 95 | As is | in stock |
| P-893228925 | Biosynth | In Stock | 95 | As is | in stock |
| P-889309571 | FluoroChem | General BB | 97 | As is | in stock |
| P-500417514 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-870647657 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-454423184 | Key Organics | Building Blocks | 95 | As is | 5 g |
| P-563582628 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-563582645 | Key Organics | Building Blocks | 97 | As is | 250 mg |
| P-596563024 | Key Organics | Building Blocks | 97 | As is | 100 g |
| P-856006682 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-856045465 | LaboTest | Building Blocks | 90 | As is | 5 g |
| P-863714592 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888880871 | PharmaBlock | In stock | N/A | As is | in stock |
| P-885538170 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33162799 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-893718545 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-894002150 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 353.410 |
| logP | 4.4153 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 99.5925 |
| Atoms | 49 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 23 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
