Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8005182152
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 | 174 USD | 95 | 22 working days | Get Quote |
| 5 mg | 174 USD | 95 | 22 working days | Get Quote |
| 10 mg | 174 USD | 95 | 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.
-
MCULE-1817854636
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8005182152.sdf |
| SMILES | MCULE-8005182152.smiles |
| Standard InChI | MCULE-8005182152.inchi |
| InChIKey | MCULE-8005182152.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612935319 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851462150 | AmBeed | On request | N/A | As is | by synthesis |
| P-596518354 | Asinex | General bb catalog | 90 | As is | unavailable |
| P-889826751 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590811616 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-901494729 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-901500794 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-852388283 | Matrix Scientific | All | N/A | As is | in stock |
| P-854853145 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502390330 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-886625657 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-889933430 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
| P-851827439 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-892495402 | Asinex | General screening catalog | 90 | As a main component | 1000 mg |
| P-590989623 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-852395499 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-854864629 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-893741986 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 257.327 |
| logP | 3.6466 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 44.48 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 76.3934 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 19 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
