MCULE-9678158236-0
- 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 | 36 USD | 92 | 15 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 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-9678158236-0.sdf |
| SMILES | MCULE-9678158236-0.smiles |
| Standard InChI | MCULE-9678158236-0.inchi |
| InChIKey | MCULE-9678158236-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-860634595 | 95 | As is | by synthesis |
| P-904545006 | 95 | As is | in stock |
| P-893452535 | 90 | As is | 7.606 g |
| P-851637777 | N/A | As is | by synthesis |
| P-869896519 | 90 | As is | 26 mg |
| P-864253574 | 95 | As is | by synthesis |
| P-590964456 | 95 | As is | by synthesis |
| P-27566943 | 90 | As is | 25 mg |
| P-141512 | 90 | As is | 92 mg |
| P-517094832 | 90 | As is | in stock |
| P-34619633 | 90 | As is | by synthesis |
| P-890209057 | 90 | As is | 300 mg |
| P-579511127 | 90 | As is | 300 mg |
| P-502467004 | 95 | As is | by synthesis |
| P-502619008 | 90 | As is | in stock |
| P-492238341 | 95 | As is | in stock |
| P-12579052 | 92 | As is | 297 mg |
| P-601068550 | 90 | As is | 2.9 g |
| P-14054853 | 95 | As is | 2.9 g |
| P-852506216 | N/A | As is | in stock |
| P-895332227 | 95 | As is | by synthesis |
| P-856106883 | 95 | As is | by synthesis |
| P-19307239 | 90 | As is | in stock |
| P-33492901 | 90 | As is | in stock |
| P-873236001 | 90 | As is | in stock |
| P-903629064 | 94 | As is | by resynthesis (? - ? days) |
| P-22553939 | 90 | As is | 8 mg |
| P-855224434 | 90 | As is | in stock |
| P-1030122 | 90 | As is | 145 mg |
| P-886928898 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 256.685 |
| logP | 3.2435 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 45.75 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.8097 |
| Atoms | 27 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |

