Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2832559100
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 | 7 USD | 70 | 20 working days | Get Quote |
| 5 mg | 7 USD | 70 | 20 working days | Get Quote |
| 10 mg | 7 USD | 70 | 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.
-
1
MCULE-8937925903
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2832559100.sdf |
| SMILES | MCULE-2832559100.smiles |
| Standard InChI | MCULE-2832559100.inchi |
| InChIKey | MCULE-2832559100.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565563 | 98 | Main component | in stock |
| P-867509523 | N/A | Main component | by synthesis |
| P-874601008 | 75 | Main component | in stock |
| P-590368808 | 90 | Main component | in stock |
| P-881674419 | 95 | Main component | in stock |
| P-874609375 | 50 | Main component | in stock |
| P-874639699 | 97 | Main component | in stock |
| P-881674418 | N/A | Main component | in stock |
| P-606831489 | N/A | Main component | in stock |
| P-865907478 | 70 | Main component | 2 kg |
| P-864188067 | 84 | Main component | in stock |
| P-893218192 | 95 | Main component | in stock |
| P-905340062 | N/A | Main component | 16.568 kg |
| P-31274460 | 90 | Main component | 10 g |
| P-856041070 | 90 | Main component | 10 g |
| P-885537147 | 95 | Main component | by synthesis |
| P-904226119 | 95 | Main component | by synthesis |
| P-904254065 | 95 | Main component | unavailable |
| P-904241627 | 95 | Main component | 89.944 g |
| P-502328532 | 90 | Main component | in stock |
| P-33163003 | 90 | Main component | 1000 mg |
| P-611447510 | 90 | Main component | in stock |
| P-892962317 | N/A | Main component as a main component | by synthesis |
| P-852203789 | 98 | Main component as a main component | by synthesis |
| P-860626590 | 98 | Main component as a main component | by synthesis |
| P-904028088 | N/A | Main component as a main component | by synthesis |
| P-881619137 | N/A | Main component as a main component | by synthesis |
| P-881624988 | N/A | Main component as a main component | by synthesis |
| P-892193582 | 98 | Main component as a main component | 10 g |
| P-900247342 | 98 | Main component as a main component | 35 g |
| P-865937981 | N/A | Main component as a main component | 3 g |
| P-889850698 | 95 | Main component as a main component | by synthesis |
| P-896031792 | 95 | Main component as a main component | in stock |
| P-905471306 | 95 | Main component as a main component | in stock |
| P-899782962 | 97 | Main component as a main component | 1000 mg |
| P-899783241 | 97 | Main component as a main component | 5 g |
| P-899782755 | 97 | Main component as a main component | 1000 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 327.545 |
| logP | 6.7738 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 15 |
| PSA | 63.32 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 104.3732 |
| Atoms | 64 |
| Rings | 0 |
| Heavy atoms | 23 |
| Hydrogen atoms | 41 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
