Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3833661859-0
Structure
Show compound
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 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.
| Name | File |
|---|---|
| SDF | MCULE-3833661859-0.sdf |
| SMILES | MCULE-3833661859-0.smiles |
| Standard InChI | MCULE-3833661859-0.inchi |
| InChIKey | MCULE-3833661859-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886655879 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889954168 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869204778 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851621373 | AmBeed | On request | N/A | As is | by synthesis |
| P-591065761 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-454756168 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-607714766 | ChemDiv | Discovery Chemistry Library | 90 | As is | 3 mg |
| P-861392052 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34792555 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580765365 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580775936 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-502471764 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-12948824 | InterBioScreen | Screening Compounds | 92 | As is | 227 mg |
| P-580463010 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-852598355 | Matrix Scientific | All | N/A | As is | in stock |
| P-854845537 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-674659449 | Pharmeks LLC | Synthetic compounds | 92 | As is | 227 mg |
| P-856064001 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 14 g |
| P-675092336 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502327215 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22471619 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 100 mg |
| P-855228672 | Toronto Research | In stock | 90 | As is | in stock |
| P-25015192 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.053 g |
| P-596527198 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.053 g |
| P-893777699 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 268.263 |
| logP | 3.71 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 59.67 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.1523 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
