Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-8964127075
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 | 103 USD | 95 | 7 working days | Get Quote |
| 5 mg | 332 USD | 98 | 20 working days | Get Quote |
| 10 mg | 561 USD | 98 | 20 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-2628239268
- Component type: Main
-
MCULE-8851196273
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8964127075.sdf |
| SMILES | MCULE-8964127075.smiles |
| Standard InChI | MCULE-8964127075.inchi |
| InChIKey | MCULE-8964127075.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892857455 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-890148914 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869214076 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893291484 | AmBeed | In stock | N/A | As is | in stock |
| P-900245195 | Angene | Building Blocks in stock | 98 | As is | 50 mg |
| P-881653807 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-901347052 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-901487189 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-869116562 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-904245144 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888632066 | TargetMol | Screening Compounds - stock amount | 95 | As is | 50 mg |
| P-855067172 | Toronto Research | In stock | 90 | As is | in stock |
| P-867649136 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-875816583 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-891659311 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-895102894 | Angene | Building Blocks in stock | 98 | As a main component | 5 mg |
| P-889522218 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 342.370 |
| logP | 3.4163 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 11 |
| PSA | 122.46 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 93.0642 |
| Atoms | 50 |
| Rings | 1 |
| Heavy atoms | 23 |
| Hydrogen atoms | 27 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
