Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9625062817
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 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.
-
MCULE-4014359946
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9625062817.sdf |
| SMILES | MCULE-9625062817.smiles |
| Standard InChI | MCULE-9625062817.inchi |
| InChIKey | MCULE-9625062817.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489231191 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-580281676 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500153202 | J&W Pharmlab | In-stock compounds | 96 | As is | in stock |
| P-489223849 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-889493061 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-872868169 | Axon Medchem | Axon predominantly SC catalog | 100 | As a main component | in stock |
| P-674290533 | ChemDiv | Building Blocks in stock | 90 | As a main component | in stock |
| P-619307221 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 12 mg |
| P-851306856 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-500143660 | Chemtos | In-stock Products | 95 | As a main component | in stock |
| P-34692301 | Crea-Chim | HTS compounds | 90 | As a main component | by resynthesis (? - ? days) |
| P-580787372 | Crea-Chim | Building Blocks | 95 | As a main component | by resynthesis (? - ? days) |
| P-580323055 | Debye Scientific | General Catalog | 97 | As a main component | by resynthesis (? - ? days) |
| P-852428238 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-675098606 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-888648811 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869146252 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-854984228 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-617769413 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 94 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 183.676 |
| logP | 3.3201 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 53.5844 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
