Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7671263939-0
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 | 43 USD | 95 | 12 working days | Get Quote |
| 5 mg | 43 USD | 95 | 12 working days | Get Quote |
| 10 mg | 43 USD | 95 | 12 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-3490399589-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7671263939-0.sdf |
| SMILES | MCULE-7671263939-0.smiles |
| Standard InChI | MCULE-7671263939-0.inchi |
| InChIKey | MCULE-7671263939-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867598898 | 95 | As is | in stock |
| P-875756817 | N/A | As is | in stock |
| P-590400128 | 95 | As is | in stock |
| P-903091180 | 95 | As is | 1000 mg |
| P-851857342 | N/A | As is | by synthesis |
| P-489110859 | 97 | As is | in stock |
| P-864120286 | 95 | As is | in stock |
| P-577179327 | 90 | As is | by synthesis |
| P-851291519 | 95 | As is | by synthesis |
| P-868595171 | 97 | As is | in stock |
| P-580291312 | N/A | As is | by resynthesis (? - ? days) |
| P-619810681 | 96 | As is | in stock |
| P-454353218 | 95 | As is | 921 mg |
| P-855992183 | 98 | As is | 100 mg |
| P-454417701 | 95 | As is | 1000 mg |
| P-596566083 | 95 | As is | 5 g |
| P-524162153 | 98 | As is | 1000 mg |
| P-615645676 | 95 | As is | in stock |
| P-31226701 | 90 | As is | 1000 mg |
| P-856039839 | 90 | As is | 1000 mg |
| P-852384914 | N/A | As is | in stock |
| P-854773343 | 95 | As is | by synthesis |
| P-491081399 | 95 | As is | by synthesis |
| P-22488206 | 90 | As is | 1000 mg |
| P-855099022 | 90 | As is | in stock |
| P-855071930 | 90 | As is | in stock |
| P-667011189 | 95 | As is | in stock |
| P-886596305 | 98 | As a main component | in stock |
| P-901266979 | N/A | As a main component | in stock |
| P-874617298 | 95 | As a main component | in stock |
| P-590382406 | 95 | As a main component | in stock |
| P-903127826 | 97 | As a main component | 5 g |
| P-610970813 | 90 | As a main component | 15.4 g |
| P-851626867 | N/A | As a main component | by synthesis |
| P-873293644 | 97 | As a main component | 5 g |
| P-589662510 | 95 | As a main component | by resynthesis (? - ? days) |
| P-889773899 | 97 | As a main component | in stock |
| P-590850396 | 95 | As a main component | by synthesis |
| P-901426085 | 95 | As a main component | by synthesis |
| P-901546257 | 95 | As a main component | by synthesis |
| P-868637805 | 97 | As a main component | in stock |
| P-619810682 | 96 | As a main component | in stock |
| P-454333190 | 90 | As a main component | unavailable |
| P-563378448 | 97 | As a main component | 5 g |
| P-855937741 | 97 | As a main component | 10 g |
| P-854836206 | 95 | As a main component | by synthesis |
| P-611489104 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 115.174 |
| logP | 0.7136 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 21.26 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.6437 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 13 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
