Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6536333043-0
Structure
Show compound
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 | 12 USD | 97 | 20 working days | Get Quote |
| 5 mg | 12 USD | 97 | 20 working days | Get Quote |
| 10 mg | 12 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-6536333043-0.sdf |
| SMILES | MCULE-6536333043-0.smiles |
| Standard InChI | MCULE-6536333043-0.inchi |
| InChIKey | MCULE-6536333043-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867671417 | 95 | As is | in stock |
| P-875845464 | N/A | As is | in stock |
| P-869317188 | 95 | As is | in stock |
| P-903216021 | 98 | As is | 15 g |
| P-851941045 | N/A | As is | in stock |
| P-865928181 | 97 | As is | 10 g |
| P-869392023 | 95 | As is | in stock |
| P-666962020 | 97 | As is | 10.45 g |
| P-3687911 | 90 | As is | 5 mg |
| P-619933383 | 90 | As is | by synthesis |
| P-607697020 | 90 | As is | 15 mg |
| P-436451184 | 95 | As is | in stock |
| P-19911289 | 90 | As is | in stock |
| P-868634862 | 95 | As is | in stock |
| P-862062998 | N/A | As is | 15.75 g |
| P-502817092 | 90 | As is | in stock |
| P-13754312 | 92 | As is | 279 mg |
| P-855971184 | 95 | As is | 5 g |
| P-852405567 | N/A | As is | in stock |
| P-854922285 | 95 | As is | by synthesis |
| P-13888044 | 92 | As is | 279 mg |
| P-19398801 | 90 | As is | in stock |
| P-33923900 | 90 | As is | in stock |
| P-873219269 | 90 | As is | in stock |
| P-888495759 | 94 | As is | by resynthesis (? - ? days) |
| P-855302998 | 90 | As is | in stock |
| P-3247445 | 90 | As is | 162 mg |
| P-872759653 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 210.234 |
| logP | 2.03338 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 61.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 60.5397 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
