Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1362146416
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 | 17 USD | 90 | 15 working days | Get Quote |
| 5 mg | 17 USD | 90 | 15 working days | Get Quote |
| 10 mg | 17 USD | 90 | 15 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-1362146416.sdf |
| SMILES | MCULE-1362146416.smiles |
| Standard InChI | MCULE-1362146416.inchi |
| InChIKey | MCULE-1362146416.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867559414 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875719392 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869191412 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-588247858 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-893252168 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-889117006 | FluoroChem | In Stock BB | N/A | As is | 1.125 kg |
| P-505516116 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-488550678 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-579616868 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31276615 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856039776 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-613284578 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580510858 | Manchester Organics | Stock compounds | 96 | As is | 2 kg |
| P-852505091 | Matrix Scientific | All | N/A | As is | in stock |
| P-620223961 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-620069246 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-454368990 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-579331073 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889852937 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502369088 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-3228263 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-3026421 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 98.143 |
| logP | 1.3278 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 12.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 27.813 |
| Atoms | 17 |
| Rings | 2 |
| Heavy atoms | 7 |
| Hydrogen atoms | 10 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
