Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1585550364
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 | 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.
| Name | File |
|---|---|
| SDF | MCULE-1585550364.sdf |
| SMILES | MCULE-1585550364.smiles |
| Standard InChI | MCULE-1585550364.inchi |
| InChIKey | MCULE-1585550364.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867584608 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875742735 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869194579 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-579762231 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-34858251 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606860364 | AmBeed | In stock | N/A | As is | in stock |
| P-489128219 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953898 | Angene | Building Blocks in stock | 98 | As is | 1.5 kg |
| P-494331056 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864167074 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-584628414 | BLD pharm | In-stock building blocks | 98 | As is | 132 g |
| P-871220891 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-868362152 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868612512 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580402691 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862130116 | FluoroChem | General BB | N/A | As is | in stock |
| P-675213997 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-579455902 | Key Organics | Building Blocks | 95 | As is | 25 g |
| P-856007004 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-615634602 | LabNetwork | In stock | 95 | As is | in stock |
| P-608084072 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31227812 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-601091853 | Life Chemicals | Building Blocks | 95 | As is | 193 mg |
| P-601076433 | Life Chemicals | Screening Compounds | 90 | As is | 193 mg |
| P-580476788 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852510985 | Matrix Scientific | All | N/A | As is | in stock |
| P-854728141 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500402176 | Pi Chemicals | Virtual Compounds | 99 | As is | by synthesis |
| P-19582179 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885522868 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596740466 | Synthonix | In-stock Building Blocks | 90 | As is | 809 g |
| P-502372438 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22467559 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 221 mg |
| P-611505174 | Toronto Research | In stock | 90 | As is | in stock |
| P-611402267 | Toronto Research | In stock | 90 | As is | in stock |
| P-3218859 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 4.409 g |
| P-1306048 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 4.409 g |
| P-893638716 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 220.265 |
| logP | 4.1956 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 71.6485 |
| Atoms | 29 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 12 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |
