Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5901282849
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 | 31 USD | 95 | 8 working days | Get Quote |
| 5 mg | 31 USD | 95 | 8 working days | Get Quote |
| 10 mg | 31 USD | 95 | 8 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-7976077440
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-5901282849.sdf |
| SMILES | MCULE-5901282849.smiles |
| Standard InChI | MCULE-5901282849.inchi |
| InChIKey | MCULE-5901282849.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886632044 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875815565 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613855340 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893577278 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 56.25 g |
| P-675053440 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-494304321 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-889589533 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481173763 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 35 g |
| P-901413152 | Biosynth | In Stock | 95 | As is | in stock |
| P-901464950 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-619342605 | ChemDiv | Discovery Chemistry Library | 90 | As is | 0 mg |
| P-868573367 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34578714 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-861298853 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-454417752 | Key Organics | Building Blocks | 97 | As is | unavailable |
| P-454354124 | Key Organics | Screening Compounds and Fragments | 97 | As is | unavailable |
| P-852453438 | Matrix Scientific | All | N/A | As is | in stock |
| P-895181464 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-899991125 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-584621312 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888880194 | PharmaBlock | In stock | N/A | As is | in stock |
| P-856063802 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 1.7 g |
| P-23849762 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-896084953 | Specs | Repurposed Compounds | N/A | As is | 1.463 g |
| P-869125715 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888639236 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-22823988 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502350156 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611432707 | Toronto Research | In stock | 90 | As is | in stock |
| P-910107 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 152 mg |
| P-3246754 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 152 mg |
| P-901167779 | XtalPi Inc. | Express Building Blocks | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 214.643 |
| logP | 2.5003 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 54.2958 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
