MCULE-9258362099
- 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 | 10 USD | 98 | 22 working days | Get Quote |
| 5 mg | 25 USD | 98 | 16 working days | Get Quote |
| 10 mg | 25 USD | 98 | 16 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-9258362099.sdf |
| SMILES | MCULE-9258362099.smiles |
| Standard InChI | MCULE-9258362099.inchi |
| InChIKey | MCULE-9258362099.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867536912 | 98 | As is | in stock |
| P-875692311 | N/A | As is | in stock |
| P-590360628 | 98 | As is | in stock |
| P-903012807 | 98 | As is | 300 mg |
| P-1264046947 | 95 | As is | in stock |
| P-893592246 | 90 | As is | 8.564 g |
| P-606871612 | N/A | As is | in stock |
| P-489230786 | 97 | As is | in stock |
| P-596936651 | 98 | As is | 300 mg |
| P-580193450 | 98 | As is | in stock |
| P-864222698 | 95 | As is | by synthesis |
| P-868544351 | 99 | As is | in stock |
| P-580720699 | 98 | As is | 206 mg |
| P-901529777 | 95 | As is | by synthesis |
| P-881633800 | 98 | As is | in stock |
| P-851249244 | 95 | As is | by synthesis |
| P-860797878 | 98 | As is | in stock |
| P-861488340 | 95 | As is | by synthesis |
| P-579479391 | 95 | As is | in stock |
| P-675213740 | 95 | As is | in stock |
| P-596576856 | 97 | As is | 100 mg |
| P-579629151 | 96 | As is | 5 g |
| P-852523041 | N/A | As is | in stock |
| P-854718767 | 95 | As is | in stock |
| P-474025870 | 95 | As is | in stock |
| P-608270311 | 98 | As is | in stock |
| P-885537008 | 95 | As is | by synthesis |
| P-579710268 | N/A | As is | in stock |
| P-869130572 | 95 | As is | by synthesis |
| P-892291920 | 95 | As is | unavailable |
| P-888642253 | 95 | As is | 30 mg |
| P-906796230 | 98 | As is | by synthesis |
| P-855051680 | 90 | As is | in stock |
| P-575295655 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 409.614 |
| logP | 6.9561 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 14 |
| PSA | 108.57 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 114.8657 |
| Atoms | 58 |
| Rings | 2 |
| Heavy atoms | 27 |
| Hydrogen atoms | 31 |
| Heteroatoms | 7 |
| 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 |

