Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5690701833
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 | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 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-5690701833.sdf |
| SMILES | MCULE-5690701833.smiles |
| Standard InChI | MCULE-5690701833.inchi |
| InChIKey | MCULE-5690701833.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579651 | 98 | As is | in stock |
| P-875739565 | N/A | As is | in stock |
| P-869181208 | 95 | As is | in stock |
| P-869196855 | 99 | As is | in stock |
| P-575539628 | 98 | As is | in stock |
| P-903069420 | 98 | As is | 29.5 kg |
| P-596988356 | 98 | As is | 29.5 kg |
| P-864195968 | 95 | As is | in stock |
| P-590635890 | 98 | As is | 625 g |
| P-454655832 | 90 | As is | in stock |
| P-607694847 | 90 | As is | 50.995 g |
| P-868606633 | 98 | As is | in stock |
| P-34744343 | 90 | As is | in stock |
| P-580284277 | N/A | As is | by resynthesis (? - ? days) |
| P-862060811 | 99 | As is | 30.3592 kg |
| P-855983048 | 97 | As is | 250 g |
| P-31135511 | 90 | As is | unavailable |
| P-856042071 | 90 | As is | unavailable |
| P-428008001 | 90 | As is | 10.029 kg |
| P-895219761 | 95 | As is | in stock |
| P-656343713 | 90 | As is | by synthesis |
| P-620220417 | 95 | As is | 1000 mg |
| P-620013748 | 90 | As is | 1000 mg |
| P-423337157 | 90 | As is | 500 mg |
| P-885539502 | 95 | As is | by synthesis |
| P-23858960 | 90 | As is | in stock |
| P-502367289 | 90 | As is | in stock |
| P-22528748 | 90 | As is | 10 mg |
| P-906866690 | 98 | As is | by synthesis |
| P-611433789 | 90 | As is | in stock |
| P-611404353 | 90 | As is | in stock |
| P-1101399 | 90 | As is | 77 mg |
| P-666976443 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 149.189 |
| logP | 2.0264 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 29.1 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 45.7207 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 11 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
