Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9548551067
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 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-3821892250
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-9548551067.sdf |
| SMILES | MCULE-9548551067.smiles |
| Standard InChI | MCULE-9548551067.inchi |
| InChIKey | MCULE-9548551067.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565851 | 95 | As is | in stock |
| P-875725582 | N/A | As is | in stock |
| P-869193445 | 95 | As is | in stock |
| P-588247731 | 99 | As is | in stock |
| P-489139853 | 97 | As is | in stock |
| P-864209156 | 95 | As is | in stock |
| P-889740614 | 95 | As is | 180 g |
| P-868611390 | 98 | As is | in stock |
| P-889112860 | 99 | As is | 50 g |
| P-488550662 | 90 | As is | in stock |
| P-856039608 | 90 | As is | 2 g |
| P-31274205 | 90 | As is | 2 g |
| P-613284105 | 95 | As is | by synthesis |
| P-852505555 | N/A | As is | in stock |
| P-621857816 | 90 | As is | by synthesis |
| P-620223932 | 95 | As is | 1000 mg |
| P-26433475 | 90 | As is | 1000 mg |
| P-454368977 | 92 | As is | in stock |
| P-889852936 | 95 | As is | by synthesis |
| P-579331071 | 90 | As is | in stock |
| P-870507874 | 99 | As is | 0 mg |
| P-502368212 | 90 | As is | in stock |
| P-3228259 | 90 | As is | unavailable |
| P-867493194 | N/A | As a component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 90.078 |
| logP | -0.0777 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 27.69 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 17.676 |
| Atoms | 12 |
| Rings | 1 |
| Heavy atoms | 6 |
| Hydrogen atoms | 6 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
