Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2069871168
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 | 5 USD | 98 | 22 working days | Get Quote |
| 5 mg | 5 USD | 98 | 22 working days | Get Quote |
| 10 mg | 5 USD | 98 | 22 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-2069871168.sdf |
| SMILES | MCULE-2069871168.smiles |
| Standard InChI | MCULE-2069871168.inchi |
| InChIKey | MCULE-2069871168.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892979506 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867563736 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-867412583 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-535627289 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505348063 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-869328621 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-893591741 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 60 mg |
| P-893337569 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-34909543 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851594344 | AmBeed | On request | N/A | As is | by synthesis |
| P-606944201 | AmBeed | In stock | N/A | As is | in stock |
| P-596928271 | Angene | Building Blocks in stock | 98 | As is | 45.3039 kg |
| P-580196057 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-494305570 | Apollo Scientific | In Stock | 95 | As is | 512.299 g |
| P-864142006 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-893245708 | Biosynth | In Stock | 95 | As is | in stock |
| P-893225234 | Biosynth | In Stock | 95 | As is | in stock |
| P-674234731 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
| P-34808050 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580276226 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862011317 | FluoroChem | General BB | 95 | As is | in stock |
| P-608220093 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-505491431 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492221053 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502765662 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488555637 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-488544412 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-856009180 | Key Organics | Biochemicals | 98 | As is | 100 mg |
| P-31162399 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613276338 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-860790554 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-881191942 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-454364036 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-13429679 | Pharmeks LLC | Natural & unique compounds | 92 | As is | 300 mg |
| P-19202689 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885524203 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579710811 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-516411725 | Specs | Natural Products | 80 | As is | 1.149 g |
| P-892304665 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892276785 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892236200 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869176182 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892352885 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-892292604 | TargetMol | In Stock BB | 95 | As is | 950 mg |
| P-892326897 | TargetMol | Screening Compounds - stock amount | 95 | As is | 950 mg |
| P-502330892 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33162697 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611369784 | Toronto Research | In stock | 90 | As is | in stock |
| P-3229012 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.129 g |
| P-1248447 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.129 g |
| P-893983334 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 180.157 |
| logP | 1.1956 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 77.76 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 47.1578 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
