Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9380301737
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 | 31 USD | 98 | 20 working days | Get Quote |
| 5 mg | 31 USD | 98 | 20 working days | Get Quote |
| 10 mg | 31 USD | 98 | 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-9380301737.sdf |
| SMILES | MCULE-9380301737.smiles |
| Standard InChI | MCULE-9380301737.inchi |
| InChIKey | MCULE-9380301737.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867500408 | N/A | As is | by synthesis |
| P-875737941 | N/A | As is | in stock |
| P-615718732 | 98 | As is | in stock |
| P-903067999 | 97 | As is | 10 g |
| P-905481109 | 97 | As is | 10 g |
| P-492324730 | 95 | As is | in stock |
| P-610975718 | 90 | As is | 123.5 g |
| P-606928101 | N/A | As is | in stock |
| P-489238642 | 97 | As is | in stock |
| P-596975914 | 98 | As is | 25 g |
| P-864112590 | 97 | As is | in stock |
| P-866716520 | 98 | As is | 1.45 g |
| P-868596912 | 98 | As is | in stock |
| P-454404241 | 95 | As is | 5 g |
| P-563393047 | 97 | As is | 5 g |
| P-563497022 | 95 | As is | 5 g |
| P-615639161 | 95 | As is | in stock |
| P-579674412 | 95 | As is | by resynthesis (? - ? days) |
| P-31258804 | 90 | As is | unavailable |
| P-854888132 | 95 | As is | by synthesis |
| P-889869059 | 95 | As is | by synthesis |
| P-502349730 | 90 | As is | in stock |
| P-596709857 | 90 | As is | 250 mg |
| P-906862972 | 98 | As is | by synthesis |
| P-611413816 | 90 | As is | in stock |
| P-615399894 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 283.295 |
| logP | 3.2571 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 71.3005 |
| Atoms | 38 |
| Rings | 1 |
| Heavy atoms | 20 |
| Hydrogen atoms | 18 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
