Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2987926118
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 | 31 USD | 95 | 14 working days | Get Quote |
| 5 mg | 31 USD | 95 | 14 working days | Get Quote |
| 10 mg | 51 USD | 95 | 8 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-2987926118.sdf |
| SMILES | MCULE-2987926118.smiles |
| Standard InChI | MCULE-2987926118.inchi |
| InChIKey | MCULE-2987926118.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875725276 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590366488 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851894266 | AmBeed | On request | N/A | As is | by synthesis |
| P-596946944 | Angene | Building Blocks in stock | 98 | As is | 60 mg |
| P-889519933 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-889743153 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 24 g |
| P-605403547 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861480826 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580301507 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862090474 | FluoroChem | General BB | N/A | As is | in stock |
| P-870648257 | Glentham Life Sciences | Compounds typically in stock | 95 | As is | in stock |
| P-492214807 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502543744 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-855953109 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-852417922 | Matrix Scientific | All | N/A | As is | in stock |
| P-863737858 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-856067166 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 24.9 g |
| P-34211805 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-869159544 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888655076 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-23335801 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502350838 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-872758554 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 169.134 |
| logP | 0.4849 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 79.54 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 38.283 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| 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 |
