Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4029778803
Compound
Show structures
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 | 10 USD | 99 | 20 working days | Get Quote |
| 5 mg | 10 USD | 99 | 20 working days | Get Quote |
| 10 mg | 10 USD | 99 | 20 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-4029778803.sdf |
| SMILES | MCULE-4029778803.smiles |
| Standard InChI | MCULE-4029778803.inchi |
| InChIKey | MCULE-4029778803.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867584678 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875743204 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869183631 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505354364 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505388981 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-34884484 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436472212 | Alinda | Building Blocks | 95 | As is | in stock |
| P-489182786 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596983905 | Angene | Building Blocks in stock | 99 | As is | 500 g |
| P-872725716 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-869824799 | Asinex | General screening catalog | 90 | As is | 82 mg |
| P-889476085 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-893221377 | Biosynth | In Stock | 95 | As is | in stock |
| P-454728651 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-851268551 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-580450126 | CliniSciences S.A.S | All products | 99 | As is | in stock |
| P-608494137 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-870652113 | Glentham Life Sciences | Compounds typically in stock | 97 | As is | in stock |
| P-505494005 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-588708713 | Key Organics | Biochemicals | 95 | As is | 4.994 g |
| P-856017495 | LaboTest | Screening Collection | 90 | As is | 5 g |
| P-852532001 | Matrix Scientific | All | N/A | As is | in stock |
| P-854717204 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-895184737 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474020561 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608276144 | Molnova | Stock | 98 | As is | in stock |
| P-500390630 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19628432 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885542559 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-498641273 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | As is | by synthesis |
| P-579711856 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-502364731 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-596709958 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 200 mg |
| P-611421236 | Toronto Research | In stock | 90 | As is | in stock |
| P-854984575 | Toronto Research | In stock | 90 | As is | in stock |
| P-854984574 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 222.251 |
| logP | 0.998 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 151.66 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 45.2161 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| 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 |
