Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5127899873
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 | 12 USD | 98 | 20 working days | Get Quote |
| 5 mg | 12 USD | 98 | 20 working days | Get Quote |
| 10 mg | 12 USD | 98 | 20 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-5127899873.sdf |
| SMILES | MCULE-5127899873.smiles |
| Standard InChI | MCULE-5127899873.inchi |
| InChIKey | MCULE-5127899873.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867612011 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875772034 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-881661164 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436452427 | Alinda | Building Blocks | 95 | As is | in stock |
| P-34851437 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606845991 | AmBeed | In stock | N/A | As is | in stock |
| P-596962863 | Angene | Building Blocks in stock | 98 | As is | 700 g |
| P-864085935 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-590638833 | BLD pharm | In-stock building blocks | 95 | As is | 240 g |
| P-893234421 | Biosynth | In Stock | 95 | As is | in stock |
| P-454639555 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-4066121 | ChemDiv | Discovery Chemistry Library | 90 | As is | 53 mg |
| P-868646979 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580426910 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-896532472 | FluoroChem | In Stock BB | N/A | As is | 5 g |
| P-505508517 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-563430205 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-615656925 | LabNetwork | In stock | 95 | As is | in stock |
| P-579663448 | LabSeeker, Inc | On demand Catalog | 97 | As is | by resynthesis (? - ? days) |
| P-852406495 | Matrix Scientific | All | N/A | As is | in stock |
| P-895222866 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-19574075 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889885100 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873229532 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888596550 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611405796 | Toronto Research | In stock | 90 | As is | in stock |
| P-1577012 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 989 mg |
| P-615405800 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 210.183 |
| logP | 1.3187 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 72.83 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 51.3923 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
