Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9101515986
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 | 16 USD | 98 | 20 working days | Get Quote |
| 5 mg | 16 USD | 98 | 20 working days | Get Quote |
| 10 mg | 16 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-9101515986.sdf |
| SMILES | MCULE-9101515986.smiles |
| Standard InChI | MCULE-9101515986.inchi |
| InChIKey | MCULE-9101515986.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875743636 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505388583 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-535624567 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-903074350 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 3 g |
| P-436459262 | Alinda | Building Blocks | 95 | As is | 99 g |
| P-425206518 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-19868820 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851450781 | AmBeed | On request | N/A | As is | by synthesis |
| P-596988792 | Angene | Building Blocks in stock | 98 | As is | 15 g |
| P-864196288 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590804491 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-454710885 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-3301741 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2.625 g |
| P-868598453 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580418309 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862030906 | FluoroChem | General BB | N/A | As is | in stock |
| P-488555746 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-524164219 | Key Organics | Building Blocks | 95 | As is | 5 g |
| P-856005818 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-856023876 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-580472010 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852431142 | Matrix Scientific | All | N/A | As is | in stock |
| P-871068893 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-885522903 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-424803424 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-873212705 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22474185 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 110 mg |
| P-611370309 | Toronto Research | In stock | 90 | As is | in stock |
| P-488720 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 3.231 g |
| P-3219350 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 3.231 g |
| P-615404737 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 287.160 |
| logP | 4.5558 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 65.76 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 71.073 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
