Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9107598887
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 | 6 USD | 98 | 20 working days | Get Quote |
| 5 mg | 6 USD | 98 | 20 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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-9107598887.sdf |
| SMILES | MCULE-9107598887.smiles |
| Standard InChI | MCULE-9107598887.inchi |
| InChIKey | MCULE-9107598887.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867563066 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875722422 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869195140 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505350942 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-608440730 | Aldlab Chemicals | Building Block Stock | 95 | As is | 57.141 g |
| P-517094266 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606834414 | AmBeed | In stock | N/A | As is | in stock |
| P-489131341 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596945844 | Angene | Building Blocks in stock | 98 | As is | 47.5 g |
| P-494349609 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864113941 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580725339 | BLD pharm | In-stock building blocks | 98 | As is | 1.045 kg |
| P-851251969 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868592900 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580421687 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500234464 | Diverchim | Diverchim General Catalog | N/A | As is | in stock |
| P-862001989 | FluoroChem | General BB | N/A | As is | in stock |
| P-505533705 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454407459 | Key Organics | Building Blocks | 97 | As is | 249 mg |
| P-454329951 | Key Organics | Screening Compounds and Fragments | 97 | As is | 249 mg |
| P-579621435 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31179427 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-856043998 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-580463851 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852524243 | Matrix Scientific | All | N/A | As is | in stock |
| P-854738346 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-500384017 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-885548718 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23890170 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596746118 | Synthonix | In-stock Building Blocks | 98 | As is | 11.335 kg |
| P-502335775 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22506543 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611369444 | Toronto Research | In stock | 90 | As is | in stock |
| P-1033195 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 8 mg |
| P-886947283 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 245.026 |
| logP | 1.8455 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 74.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 48.0606 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
