MCULE-2511482745
- 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 | 19 USD | 98 | 20 working days | Get Quote |
| 5 mg | 19 USD | 98 | 20 working days | Get Quote |
| 10 mg | 19 USD | 98 | 20 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.
-
MCULE-3688934722
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-2511482745.sdf |
| SMILES | MCULE-2511482745.smiles |
| Standard InChI | MCULE-2511482745.inchi |
| InChIKey | MCULE-2511482745.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867640291 | 98 | As is | in stock |
| P-875806105 | N/A | As is | in stock |
| P-869342622 | 95 | As is | in stock |
| P-903163650 | 98 | As is | 35 g |
| P-893550049 | 90 | As is | 161.92 g |
| P-606845936 | N/A | As is | in stock |
| P-865922212 | 98 | As is | 10 g |
| P-589658912 | 95 | As is | by resynthesis (? - ? days) |
| P-864209951 | 95 | As is | in stock |
| P-861316089 | 98 | As is | 10.825 g |
| P-893226733 | 95 | As is | in stock |
| P-4170483 | 90 | As is | 100 mg |
| P-454686377 | 90 | As is | in stock |
| P-584545113 | 90 | As is | 2 mg |
| P-436443827 | 90 | As is | 16.084 g |
| P-436474293 | 95 | As is | 24 g |
| P-425022499 | 90 | As is | in stock |
| P-868561146 | 98 | As is | in stock |
| P-855978150 | 95 | As is | 25 g |
| P-852534143 | N/A | As is | in stock |
| P-854758008 | 95 | As is | in stock |
| P-888876061 | N/A | As is | in stock |
| P-491252407 | 95 | As is | by synthesis |
| P-33501629 | 90 | As is | in stock |
| P-502337878 | 90 | As is | in stock |
| P-888595915 | 94 | As is | by resynthesis (? - ? days) |
| P-611377862 | 90 | As is | in stock |
| P-868542815 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 192.167 |
| logP | 0.9131 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 71.44 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 48.2223 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| 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 |

