Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9424350399
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 | 156 USD | 90 | 30 working days | Get Quote |
| 5 mg | 181 USD | 90 | 30 working days | Get Quote |
| 10 mg | 194 USD | 90 | 30 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-9737853455
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9424350399.sdf |
| SMILES | MCULE-9424350399.smiles |
| Standard InChI | MCULE-9424350399.inchi |
| InChIKey | MCULE-9424350399.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892980545 | N/A | As is | by synthesis |
| P-904589148 | 95 | As is | in stock |
| P-851829463 | N/A | As is | by synthesis |
| P-591014171 | 95 | As is | by synthesis |
| P-890216343 | 90 | As is | in stock |
| P-590338777 | 90 | As is | 1000 mg |
| P-869023950 | 95 | As is | by synthesis |
| P-491089617 | 95 | As is | by synthesis |
| P-33985476 | 90 | As is | in stock |
| P-502389073 | 90 | As is | in stock |
| P-867411109 | N/A | As a main component | by synthesis |
| P-874647221 | 97 | As a main component | in stock |
| P-901424396 | 95 | As a main component | by synthesis |
| P-861274836 | 95 | As a main component | in stock |
| P-675496968 | 95 | As a main component | in stock |
| P-881171135 | 95 | As a main component | by synthesis |
| P-854898676 | 95 | As a main component | by synthesis |
| P-894004609 | 95 | As a main component | in stock |
| P-894010744 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.216 |
| logP | 2.2101 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.1074 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
