Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-2096184994
Compound
Show structures
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 | 5 USD | 98 | 16 working days | Get Quote |
| 5 mg | 5 USD | 98 | 16 working days | Get Quote |
| 10 mg | 5 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.
-
MCULE-6117698403
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2096184994.sdf |
| SMILES | MCULE-2096184994.smiles |
| Standard InChI | MCULE-2096184994.inchi |
| InChIKey | MCULE-2096184994.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867517620 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-867587458 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875746468 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-875780793 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-608433968 | Aldlab Chemicals | Building Block Stock | 95 | As is | 180.651 g |
| P-606839092 | AmBeed | In stock | N/A | As is | in stock |
| P-596954827 | Angene | Building Blocks in stock | 98 | As is | 6.64073 kg |
| P-889445825 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-864151635 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868545709 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-579804948 | Eximed | In-stock screening compounds | 90 | As is | 5.81 g |
| P-888750917 | Eximed | In-stock screening compounds | 90 | As is | 5 g |
| P-580089826 | Eximed | Building Block Catalog | 95 | As is | 5.81 g |
| P-505494663 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-870569158 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-870580399 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488555931 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-488543824 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-620221442 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 5.81 g |
| P-617666263 | Otava | In-House Stock Library | 90 | As is | 5.81 g |
| P-454363779 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500371909 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-888627055 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869108011 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-502372168 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-464690076 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 3.107 g |
| P-2376671 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 3.107 g |
| P-480999176 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| P-875709055 | AA Blocks | AA Blocks | N/A | As a main component | in stock |
| P-505393599 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-889508416 | AstaTech | Backordered BBs | 98 | As a main component | by synthesis |
| P-505530228 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 229.259 |
| logP | -0.0129 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 115.67 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 56.3082 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
