Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7079696193
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 | 15 USD | 89 | 22 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-7079696193.sdf |
| SMILES | MCULE-7079696193.smiles |
| Standard InChI | MCULE-7079696193.inchi |
| InChIKey | MCULE-7079696193.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867655992 | A2B Chem | Predominantly Building Block in stock | 89 | As is | in stock |
| P-890164077 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869283860 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-19900261 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436465185 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851414314 | AmBeed | On request | N/A | As is | by synthesis |
| P-590731824 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-504728218 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
| P-454721913 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-607694569 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
| P-861524015 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34754567 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-596547411 | Key Organics | Screening Compounds and Fragments | 95 | As is | unavailable |
| P-852446621 | Matrix Scientific | All | N/A | As is | in stock |
| P-854929543 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-659619303 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-23817944 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-453962393 | Specs | Screening Compounds | 90 | As is | 13 mg |
| P-22479627 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 120 mg |
| P-855347521 | Toronto Research | In stock | 90 | As is | in stock |
| P-35055860 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 24 mg |
| P-893802302 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 187.198 |
| logP | 1.735 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 57.78 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 52.8019 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
