Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7807455544
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 | 20 USD | 98 | 20 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 20 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-7807455544.sdf |
| SMILES | MCULE-7807455544.smiles |
| Standard InChI | MCULE-7807455544.inchi |
| InChIKey | MCULE-7807455544.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867644175 | 98 | As is | in stock |
| P-875810294 | N/A | As is | in stock |
| P-595217535 | 95 | As is | in stock |
| P-903170438 | 98 | As is | 90 g |
| P-893600495 | 90 | As is | 128.455 g |
| P-851816876 | N/A | As is | by synthesis |
| P-596990052 | 98 | As is | 40 g |
| P-895956328 | 95 | As is | 21 g |
| P-596427061 | 90 | As is | 815 mg |
| P-596515411 | 90 | As is | 815 mg |
| P-864176868 | 98 | As is | in stock |
| P-590987712 | 98 | As is | by synthesis |
| P-577155972 | 90 | As is | by synthesis |
| P-874588469 | 90 | As is | 2.009 g |
| P-436464085 | 95 | As is | 25 g |
| P-888189208 | 90 | As is | in stock |
| P-425022314 | 90 | As is | in stock |
| P-861483818 | 95 | As is | by synthesis |
| P-881674668 | N/A | As is | by resynthesis (? - ? days) |
| P-861931827 | 95 | As is | 85.503 g |
| P-890217368 | 90 | As is | in stock |
| P-590339797 | 90 | As is | 1000 mg |
| P-502502791 | 95 | As is | by synthesis |
| P-504465973 | 90 | As is | by synthesis |
| P-502804946 | 90 | As is | in stock |
| P-492227546 | 95 | As is | in stock |
| P-891644624 | 95 | As is | 90 mg |
| P-524170882 | 95 | As is | 90 mg |
| P-615656559 | 95 | As is | in stock |
| P-31268296 | 90 | As is | unavailable |
| P-852434568 | N/A | As is | in stock |
| P-35162251 | 90 | As is | 10.335 kg |
| P-872796259 | 95 | As is | in stock |
| P-12375619 | 90 | As is | 100 mg |
| P-888892019 | N/A | As is | in stock |
| P-19086139 | 90 | As is | in stock |
| P-904097775 | 97 | As is | 120.58 g |
| P-502387536 | 90 | As is | in stock |
| P-23338877 | 94 | As is | by resynthesis (? - ? days) |
| P-611365796 | 90 | As is | in stock |
| P-611492836 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 191.158 |
| logP | 1.3201 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 37.38 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.968 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
