Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3854202417
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 | 5 USD | 95 | 9 working days | Get Quote |
| 5 mg | 5 USD | 95 | 9 working days | Get Quote |
| 10 mg | 5 USD | 95 | 9 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-3854202417.sdf |
| SMILES | MCULE-3854202417.smiles |
| Standard InChI | MCULE-3854202417.inchi |
| InChIKey | MCULE-3854202417.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867554609 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875713411 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869187890 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505390697 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580200114 | Aldlab Chemicals | Building Block Stock | 95 | As is | 400.5 g |
| P-436474160 | Alinda | Building Blocks | 95 | As is | in stock |
| P-606893722 | AmBeed | In stock | N/A | As is | in stock |
| P-489176213 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596942812 | Angene | Building Blocks in stock | 95 | As is | 2.66 kg |
| P-494350883 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864084951 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-580721827 | BLD pharm | In-stock building blocks | 95 | As is | 70 g |
| P-454735268 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-3282753 | ChemDiv | Discovery Chemistry Library | 90 | As is | 38 mg |
| P-868651065 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580425975 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889115072 | FluoroChem | In Stock BB | N/A | As is | 34 g |
| P-494300528 | Frinton Laboratories | Frinton Building Blocks | 99 | As is | in stock |
| P-870660160 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-505491474 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502742501 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-454391767 | Key Organics | Building Blocks | 95 | As is | 246 mg |
| P-454298137 | Key Organics | Screening Compounds and Fragments | 95 | As is | 246 mg |
| P-31161659 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580467222 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-852444250 | Matrix Scientific | All | N/A | As is | in stock |
| P-854732049 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-500382456 | Pi Chemicals | Virtual Compounds | 99 | As is | by synthesis |
| P-18968419 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885547910 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596775024 | Synthonix | In-stock Building Blocks | 95 | As is | 3.816 kg |
| P-502332630 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611365399 | Toronto Research | In stock | 90 | As is | in stock |
| P-3243984 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 153 mg |
| P-615394560 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.216 |
| logP | 2.93088 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 44.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 58.616 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
