Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8639113848
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 | 96 USD | 95 | 12 working days | Get Quote |
| 5 mg | 112 USD | 95 | 12 working days | Get Quote |
| 10 mg | 138 USD | 95 | 12 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-8639113848.sdf |
| SMILES | MCULE-8639113848.smiles |
| Standard InChI | MCULE-8639113848.inchi |
| InChIKey | MCULE-8639113848.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892864680 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890158986 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-894645464 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903157166 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 1000 mg |
| P-436458626 | Alinda | Building Blocks | 95 | As is | in stock |
| P-578431252 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851896978 | AmBeed | On request | N/A | As is | by synthesis |
| P-888819405 | Angene | Building Blocks in stock | 95 | As is | 5 g |
| P-889813728 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-893231730 | Biosynth | In Stock | 95 | As is | in stock |
| P-577179142 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-10023291 | ChemDiv | Discovery Chemistry Library | 90 | As is | 176 mg |
| P-893618927 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580439511 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889405452 | FluoroChem | General BB | 95 | As is | in stock |
| P-502450800 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502690381 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492215182 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-856014828 | LaboTest | Screening Collection | 90 | As is | 500 mg |
| P-852430664 | Matrix Scientific | All | N/A | As is | in stock |
| P-854923598 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-890842918 | Rare Chemicals GmbH | In stock | 95 | As is | in stock |
| P-502351095 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-903955882 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-23322957 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611382236 | Toronto Research | In stock | 90 | As is | in stock |
| P-894007346 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.151 |
| logP | 1.3111 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 67.51 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.8945 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
