Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5948201879
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 | 13 USD | 97 | 24 working days | Get Quote |
| 5 mg | 13 USD | 97 | 24 working days | Get Quote |
| 10 mg | 13 USD | 97 | 24 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-6450156540
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5948201879.sdf |
| SMILES | MCULE-5948201879.smiles |
| Standard InChI | MCULE-5948201879.inchi |
| InChIKey | MCULE-5948201879.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869193095 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505389424 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-505391003 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606925316 | AmBeed | In stock | N/A | As is | in stock |
| P-872728019 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-889450519 | AstaTech | Backordered BBs | 97 | As is | by synthesis |
| P-500415392 | AvaChem Scientific | All products | 95 | As is | by synthesis |
| P-866714606 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-851280721 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868592564 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862113310 | FluoroChem | General BB | N/A | As is | in stock |
| P-500417427 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-856009042 | Key Organics | Biochemicals | 99 | As is | 4.978 g |
| P-675206145 | Life Chemicals | Screening Compounds | 90 | As is | unavailable |
| P-854715536 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-608274603 | Molnova | Stock | 98 | As is | in stock |
| P-500388733 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-617402957 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-888626895 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869107867 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-31164923 | LaboTest | Screening Collection | 90 | As a main component | 500 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 381.678 |
| logP | 5.8014 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 27.05 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 98.192 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
