MCULE-7964905907
- 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 | 28 USD | 98 | 22 working days | Get Quote |
| 5 mg | 50 USD | 98 | 16 working days | Get Quote |
| 10 mg | 52 USD | 98 | 11 working days | Get Quote |
- 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-7964905907.sdf |
| SMILES | MCULE-7964905907.smiles |
| Standard InChI | MCULE-7964905907.inchi |
| InChIKey | MCULE-7964905907.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867553594 | 98 | As is | in stock |
| P-875712128 | 98 | As is | in stock |
| P-1264056303 | 99 | As is | in stock |
| P-904326420 | 90 | As is | 2.99 g |
| P-1270340450 | 98 | As is | in stock |
| P-893291956 | N/A | As is | in stock |
| P-489229791 | 97 | As is | in stock |
| P-868838015 | 98 | As is | 500 mg |
| P-1273450812 | 95 | As is | by resynthesis (? - ? days) |
| P-896023852 | 95 | As is | in stock |
| P-500416455 | 98 | As is | by synthesis |
| P-893280524 | 98 | As is | 416 mg |
| P-901459357 | 95 | As is | by synthesis |
| P-452654416 | 98 | As is | in stock |
| P-851312883 | 95 | As is | by synthesis |
| P-887202680 | 95 | As is | by synthesis |
| P-579477721 | 95 | As is | in stock |
| P-675218920 | 95 | As is | in stock |
| P-873243433 | 97 | As is | 5 mg |
| P-1272585595 | 95 | As is | 250 mg |
| P-852459645 | 95 | As is | by synthesis |
| P-854691412 | 95 | As is | in stock |
| P-896629328 | 95 | As is | by synthesis |
| P-871064695 | 95 | As is | in stock |
| P-608279341 | 98 | As is | in stock |
| P-617404702 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 300.262 |
| logP | 2.5854 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 100.13 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 80.481 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |

