MCULE-8377025602
- 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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 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-8377025602.sdf |
| SMILES | MCULE-8377025602.smiles |
| Standard InChI | MCULE-8377025602.inchi |
| InChIKey | MCULE-8377025602.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564101 | 98 | As is | in stock |
| P-875723298 | N/A | As is | in stock |
| P-535626664 | 97 | As is | in stock |
| P-505351446 | 99 | As is | in stock |
| P-903052692 | 98 | As is | 2 kg |
| P-905477820 | 98 | As is | 100 g |
| P-580199516 | 95 | As is | 10 g |
| P-606928736 | N/A | As is | in stock |
| P-489117216 | 97 | As is | in stock |
| P-596928531 | 98 | As is | 6.5 kg |
| P-494345279 | 95 | As is | 831 g |
| P-864178044 | 95 | As is | in stock |
| P-889740211 | 95 | As is | 15.5 g |
| P-580721262 | 98 | As is | 3.075 kg |
| P-893231388 | 95 | As is | in stock |
| P-452656335 | 98 | As is | in stock |
| P-34910490 | 90 | As is | in stock |
| P-851270762 | 95 | As is | by synthesis |
| P-868595093 | 97 | As is | in stock |
| P-580402585 | 95 | As is | by resynthesis (? - ? days) |
| P-905338197 | 98 | As is | 1.375 kg |
| P-870655341 | N/A | As is | in stock |
| P-505492083 | 95 | As is | in stock |
| P-885853651 | 96 | As is | in stock |
| P-856009906 | 95 | As is | unavailable |
| P-454407010 | 95 | As is | 500 g |
| P-454329127 | 95 | As is | 944 mg |
| P-579616735 | 99 | As is | 5 kg |
| P-856041651 | 90 | As is | unavailable |
| P-31253216 | 90 | As is | 500 mg |
| P-613276688 | 95 | As is | by synthesis |
| P-580512183 | N/A | As is | 640 g |
| P-852443953 | N/A | As is | in stock |
| P-904639959 | 95 | As is | in stock |
| P-854692226 | 95 | As is | in stock |
| P-579724926 | 90 | As is | in stock |
| P-888165071 | 90 | As is | in stock |
| P-608280052 | 98 | As is | in stock |
| P-500402037 | 98 | As is | by synthesis |
| P-885547607 | 95 | As is | by synthesis |
| P-519877733 | 90 | As is | in stock |
| P-617402064 | N/A | As is | in stock |
| P-904097882 | 98 | As is | 3.2501 kg |
| P-580050677 | 95 | As is | by synthesis |
| P-869176734 | 95 | As is | in stock |
| P-892293990 | 95 | As is | unavailable |
| P-892333819 | 95 | As is | 202 mg |
| P-502367406 | 90 | As is | in stock |
| P-888439638 | 94 | As is | by resynthesis (? - ? days) |
| P-906776074 | 98 | As is | by synthesis |
| P-611527281 | 90 | As is | in stock |
| P-575296240 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 124.137 |
| logP | 0.8845 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 40.46 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 34.5928 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 8 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

