Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8188700361
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-8188700361.sdf |
| SMILES | MCULE-8188700361.smiles |
| Standard InChI | MCULE-8188700361.inchi |
| InChIKey | MCULE-8188700361.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867661976 | 98 | As is | in stock |
| P-875831130 | N/A | As is | in stock |
| P-590371847 | 98 | As is | in stock |
| P-893522088 | 90 | As is | 25 g |
| P-893301036 | N/A | As is | in stock |
| P-851516690 | N/A | As is | by synthesis |
| P-489149401 | 97 | As is | in stock |
| P-589657609 | 95 | As is | by resynthesis (? - ? days) |
| P-870064158 | 90 | As is | 1000 mg |
| P-596503619 | 90 | As is | 1000 mg |
| P-864099929 | 95 | As is | in stock |
| P-454702214 | 90 | As is | in stock |
| P-131887 | 90 | As is | 3 mg |
| P-436451631 | 95 | As is | 13 g |
| P-868606831 | 97 | As is | in stock |
| P-580417847 | 95 | As is | by resynthesis (? - ? days) |
| P-502449247 | 95 | As is | by synthesis |
| P-13108908 | 95 | As is | 292 mg |
| P-18820420 | 95 | As is | 158.445 g |
| P-454417003 | 95 | As is | 158.445 g |
| P-852380507 | N/A | As is | in stock |
| P-854834140 | 95 | As is | by synthesis |
| P-13560642 | 92 | As is | 292 mg |
| P-500379350 | 95 | As is | by synthesis |
| P-23893308 | 90 | As is | in stock |
| P-33447249 | 90 | As is | in stock |
| P-502334453 | 90 | As is | in stock |
| P-903651241 | 94 | As is | by resynthesis (? - ? days) |
| P-1406979 | 90 | As is | 53 mg |
| P-893681766 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 191.187 |
| logP | 0.906 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 68.01 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 50.1758 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
