Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8935703935
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 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-8935703935.sdf |
| SMILES | MCULE-8935703935.smiles |
| Standard InChI | MCULE-8935703935.inchi |
| InChIKey | MCULE-8935703935.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565501 | 98 | As is | in stock |
| P-875725380 | N/A | As is | in stock |
| P-903054431 | 98 | As is | 2 kg |
| P-617064608 | N/A | As is | in stock |
| P-489150371 | 97 | As is | in stock |
| P-596929057 | 98 | As is | unavailable |
| P-864096080 | 98 | As is | in stock |
| P-893259653 | 95 | As is | by synthesis |
| P-505573137 | 98 | As is | in stock |
| P-454640162 | 90 | As is | in stock |
| P-580414758 | 95 | As is | by resynthesis (? - ? days) |
| P-870656295 | N/A | As is | in stock |
| P-855997765 | 97 | As is | 100 mg |
| P-454387015 | 97 | As is | 250 g |
| P-579612195 | 98 | As is | unavailable |
| P-31161117 | 90 | As is | unavailable |
| P-856040858 | 90 | As is | unavailable |
| P-613283933 | 95 | As is | by synthesis |
| P-580474884 | N/A | As is | by synthesis |
| P-852425806 | N/A | As is | in stock |
| P-608274709 | 98 | As is | in stock |
| P-492280127 | 97 | As is | 2 g |
| P-26433899 | 90 | As is | 2 g |
| P-888865762 | N/A | As is | in stock |
| P-500382700 | 98 | As is | by synthesis |
| P-885535461 | 95 | As is | by synthesis |
| P-424839360 | 90 | As is | in stock |
| P-613807678 | 95 | As is | in stock |
| P-464630983 | 95 | As is | by synthesis |
| P-892288371 | 95 | As is | unavailable |
| P-888632143 | 95 | As is | 203 mg |
| P-502365286 | 90 | As is | in stock |
| P-906770192 | 98 | As is | by synthesis |
| P-611458417 | 90 | As is | in stock |
| P-25436838 | 90 | As is | unavailable |
| P-590420178 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 171.194 |
| logP | 0.7457 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 46.61 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 47.141 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| 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 |
