Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3766215049-0
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 | 28 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 37 USD | 98 | 16 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-3766215049-0.sdf |
| SMILES | MCULE-3766215049-0.smiles |
| Standard InChI | MCULE-3766215049-0.inchi |
| InChIKey | MCULE-3766215049-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867636316 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875801342 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590359744 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-888731241 | AmBeed | In stock | N/A | As is | in stock |
| P-619200859 | Angene | Building Blocks in stock | 98 | As is | 2 g |
| P-889778205 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-890243386 | BLD pharm | In-stock building blocks | 98 | As is | 1.35 g |
| P-893255244 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-861481940 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-870660753 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-588708708 | Key Organics | Biochemicals | 98 | As is | unavailable |
| P-31178132 | LaboTest | Screening Collection | 90 | As is | 250 mg |
| P-854712463 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474023320 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-619672756 | Molnova | Stock | 98 | As is | in stock |
| P-498641272 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | As is | by synthesis |
| P-594274007 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295639 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888656624 | TargetMol | Screening Compounds - stock amount | 95 | As is | 39 mg |
| P-22526437 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 978 mg |
| P-615417696 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 258.322 |
| logP | 3.1235 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 118.9 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 61.9134 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| 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 |
