Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5350813849
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 | 8 USD | 98 | 16 working days | Get Quote |
| 5 mg | 8 USD | 98 | 16 working days | Get Quote |
| 10 mg | 8 USD | 98 | 16 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-1075197010
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5350813849.sdf |
| SMILES | MCULE-5350813849.smiles |
| Standard InChI | MCULE-5350813849.inchi |
| InChIKey | MCULE-5350813849.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867644146 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875810563 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-615727679 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-866100325 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | unavailable |
| P-606840159 | AmBeed | In stock | N/A | As is | in stock |
| P-489185559 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596996463 | Angene | Building Blocks in stock | 98 | As is | 7.4 g |
| P-494334982 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864094396 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-617431060 | BLD pharm | In-stock building blocks | 98 | As is | 1.35 g |
| P-505588271 | Chemcia | Stock compounds | 98 | As is | in stock |
| P-851264451 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868590433 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862024290 | FluoroChem | General BB | N/A | As is | in stock |
| P-596575690 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-870640739 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-615646493 | LabNetwork | In stock | 95 | As is | in stock |
| P-674293832 | Life Chemicals | Screening Compounds | 90 | As is | 1.467 g |
| P-860600909 | Life Chemicals | Building Blocks | 95 | As is | 1.467 g |
| P-852437909 | Matrix Scientific | All | N/A | As is | in stock |
| P-863704295 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-492281118 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 168 mg |
| P-12688543 | Otava | In-House Stock Library | 90 | As is | 168 mg |
| P-498714808 | Synthonix | In-stock Building Blocks | 97 | As is | 13 g |
| P-611456795 | Toronto Research | In stock | 90 | As is | in stock |
| P-615418647 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-617649492 | ChemDiv | Building Blocks in stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 204.225 |
| logP | 1.8194 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 43.6 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.2445 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| 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 |
