Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7216243368
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 45 USD | 90 | 22 working days | Get Quote |
| 10 mg | 60 USD | 90 | 22 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.
-
1
MCULE-6809511574
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7216243368.sdf |
| SMILES | MCULE-7216243368.smiles |
| Standard InChI | MCULE-7216243368.inchi |
| InChIKey | MCULE-7216243368.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-24170783 | InterBioScreen | Screening Compounds | 92 | As is | 112 mg |
| P-4626483 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 100 mg |
| P-674277639 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 42 mg |
| P-278340297 | Crea-Chim | HTS compounds | 90 | Main component | unavailable |
| P-502564140 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-503868315 | Innovapharm | Virtual Screening Compounds | 90 | Main component | by synthesis |
| P-502598306 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-502736229 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-31242591 | LaboTest | Screening Collection | 90 | Main component | 500 mg |
| P-856015976 | LaboTest | Screening Collection | 90 | Main component | 500 mg |
| P-424799347 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-519981381 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-520080738 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-896177872 | Specs | Screening Compounds | 90 | Main component | 10 mg |
| P-453920178 | Specs | Screening Compounds | 90 | Main component | 11 mg |
| P-35073222 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 194 mg |
| P-2047444 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 49 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 294.328 |
| logP | 2.3533 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 124.78 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 82.1232 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 1 |
