MCULE-9183864140
- 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 | 23 USD | 98 | 16 working days | Get Quote |
| 5 mg | 36 USD | 98 | 16 working days | Get Quote |
| 10 mg | 63 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-9183864140.sdf |
| SMILES | MCULE-9183864140.smiles |
| Standard InChI | MCULE-9183864140.inchi |
| InChIKey | MCULE-9183864140.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867605967 | 98 | As is | in stock |
| P-875764252 | N/A | As is | in stock |
| P-869303507 | 95 | As is | in stock |
| P-903100875 | 95 | As is | 100 mg |
| P-1264052421 | 95 | As is | in stock |
| P-893607591 | 90 | As is | 20.176 g |
| P-891645895 | N/A | As is | in stock |
| P-895095803 | 99 | As is | 100 mg |
| P-889522269 | 95 | As is | by synthesis |
| P-887190700 | 95 | As is | by synthesis |
| P-608497518 | 95 | As is | in stock |
| P-873245571 | 97 | As is | 50 mg |
| P-854713607 | 95 | As is | in stock |
| P-871072087 | 95 | As is | in stock |
| P-878648198 | 98 | As is | in stock |
| P-869160766 | 95 | As is | by synthesis |
| P-892294782 | 95 | As is | unavailable |
| P-888656003 | 95 | As is | 2.982 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 380.350 |
| logP | 3.1596 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 6 |
| PSA | 139.12 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 102.9624 |
| Atoms | 44 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 16 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |

