Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6725315299
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 | 23 USD | N/A | 22 working days | Get Quote |
| 5 mg | 23 USD | N/A | 22 working days | Get Quote |
| 10 mg | 23 USD | N/A | 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-6725315299.sdf |
| SMILES | MCULE-6725315299.smiles |
| Standard InChI | MCULE-6725315299.inchi |
| InChIKey | MCULE-6725315299.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867644396 | A2B Chem | Predominantly Building Block in stock | 94 | As is | in stock |
| P-875811465 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-590374781 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851482027 | AmBeed | On request | N/A | As is | by synthesis |
| P-494308641 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-590927129 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-4235463 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 10 mg |
| P-861397813 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-861922632 | FluoroChem | General BB | N/A | As is | in stock |
| P-502446959 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503087029 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502614142 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-856018720 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-852376131 | Matrix Scientific | All | N/A | As is | in stock |
| P-35226907 | Maybridge | Screening Collection | 90 | As is | 74 g |
| P-864075451 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12353792 | Otava | In-House Stock Library | 90 | As is | 1 mg |
| P-23301104 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-611369572 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 281.210 |
| logP | 3.3135 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 108.42 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 58.5658 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 6 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
