MCULE-9291534992-0
- 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 | 18 USD | 98 | 14 working days | Get Quote |
| 5 mg | 43 USD | 98 | 14 working days | Get Quote |
| 10 mg | 56 USD | 98 | 14 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-9291534992-0.sdf |
| SMILES | MCULE-9291534992-0.smiles |
| Standard InChI | MCULE-9291534992-0.inchi |
| InChIKey | MCULE-9291534992-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867678707 | 98 | As is | in stock |
| P-875856290 | 98 | As is | in stock |
| P-869218554 | 95 | As is | by resynthesis (? - ? days) |
| P-903302978 | 98 | As is | 500 mg |
| P-1264056951 | 99 | As is | in stock |
| P-893607683 | 90 | As is | 886 mg |
| P-1270352196 | 98 | As is | in stock |
| P-889752334 | N/A | As is | in stock |
| P-895105837 | 98 | As is | 250 mg |
| P-1273256548 | 95 | As is | by resynthesis (? - ? days) |
| P-1275490037 | 95 | As is | in stock |
| P-890243538 | 98 | As is | 387 mg |
| P-851314995 | 95 | As is | by synthesis |
| P-860800455 | 98 | As is | in stock |
| P-1263259989 | 95 | As is | by synthesis |
| P-579482473 | 95 | As is | in stock |
| P-675217358 | 95 | As is | in stock |
| P-873252034 | 97 | As is | 5 mg |
| P-854717556 | 95 | As is | in stock |
| P-584627043 | 95 | As is | in stock |
| P-878641849 | 98 | As is | in stock |
| P-617404306 | 98 | As is | in stock |
| P-892295162 | 95 | As is | unavailable |
| P-869161174 | 95 | As is | 50 mg |
| P-888656395 | 95 | As is | 50 mg |
| P-855345354 | 90 | As is | in stock |
| P-1271707237 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 640.681 |
| logP | 5.1531 |
| H-bond acceptors | 11 |
| H-bond donors | 4 |
| Rotatable bonds | 12 |
| PSA | 163.85 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 172.8389 |
| Atoms | 76 |
| Rings | 5 |
| Heavy atoms | 45 |
| Hydrogen atoms | 31 |
| Heteroatoms | 15 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

