Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6462079593
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 | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 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-1806676775
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6462079593.sdf |
| SMILES | MCULE-6462079593.smiles |
| Standard InChI | MCULE-6462079593.inchi |
| InChIKey | MCULE-6462079593.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885951097 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-34860001 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-596293458 | Asinex | General screening catalog | 90 | As is | 443 mg |
| P-4326119 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-502794352 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12505805 | InterBioScreen | Screening Compounds | 92 | As is | 227 mg |
| P-856029509 | LaboTest | Screening Collection | 90 | As is | 100 mg |
| P-14204668 | Life Chemicals | Screening Compounds | 90 | As is | 123 mg |
| P-35203318 | Maybridge | Screening Collection | 90 | As is | 2.472 kg |
| P-12325329 | Otava | In-House Stock Library | 90 | As is | 100 mg |
| P-18893906 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-856107356 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-589631663 | Selleckchem | Epigenetics | N/A | As is | in stock |
| P-12298887 | Specs | Screening Compounds | 90 | As is | 179 mg |
| P-888433550 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-2178004 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 306 mg |
| P-886176283 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-25746874 | Life Chemicals | Screening Compounds | 90 | As a main component | 17 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 310.389 |
| logP | 2.4255 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 37.63 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 96.4918 |
| Atoms | 45 |
| Rings | 4 |
| Heavy atoms | 23 |
| Hydrogen atoms | 22 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
