Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3275771291-0
Structure
Show compound
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 | 5 USD | 98 | 8 working days | Get Quote |
| 5 mg | 5 USD | 98 | 8 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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-8084262259-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3275771291-0.sdf |
| SMILES | MCULE-3275771291-0.smiles |
| Standard InChI | MCULE-3275771291-0.inchi |
| InChIKey | MCULE-3275771291-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565321 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875725193 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-606910338 | AmBeed | In stock | N/A | As is | in stock |
| P-864220707 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-580719948 | BLD pharm | In-stock building blocks | 98 | As is | 1.377 kg |
| P-505605678 | Chemcia | Virtual compounds | 95 | As is | by synthesis |
| P-868571924 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-889254070 | FluoroChem | General BB | N/A | As is | in stock |
| P-890205372 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579486877 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-31252361 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-852488180 | Matrix Scientific | All | N/A | As is | in stock |
| P-854732257 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888869908 | PharmaBlock | In stock | N/A | As is | in stock |
| P-498707148 | Synthonix | In-stock Building Blocks | 95 | As is | 650 g |
| P-23348708 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611479778 | Toronto Research | In stock | 90 | As is | in stock |
| P-886889197 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| P-590365412 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-851485330 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-889445847 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-590768291 | BLD pharm | Non-stock building blocks | 98 | As a main component | by synthesis |
| P-851286986 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-862047016 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-524184006 | Key Organics | Building Blocks | 95 | As a main component | 25 g |
| P-855995979 | Key Organics | Screening Compounds and Fragments | 95 | As a main component | 100 mg |
| P-596779852 | Synthonix | In-stock Building Blocks | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.113 |
| logP | 0.1963 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 54.98 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 29.8672 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| 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 |
