MCULE-8277820773-0
- 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 | 5 USD | 97 | 20 working days | Get Quote |
| 5 mg | 5 USD | 97 | 20 working days | Get Quote |
| 10 mg | 5 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-8277820773-0.sdf |
| SMILES | MCULE-8277820773-0.smiles |
| Standard InChI | MCULE-8277820773-0.inchi |
| InChIKey | MCULE-8277820773-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586409 | 99 | As is | in stock |
| P-867586411 | 95 | As is | in stock |
| P-867403477 | 90 | As is | by synthesis |
| P-869186972 | 98 | As is | in stock |
| P-505353418 | 99 | As is | in stock |
| P-881671667 | 98 | As is | in stock |
| P-874655692 | 97 | As is | in stock |
| P-851840499 | N/A | As is | by synthesis |
| P-606942223 | N/A | As is | in stock |
| P-606932442 | N/A | As is | in stock |
| P-596976326 | 99 | As is | 250 kg |
| P-596954354 | 97 | As is | 50 kg |
| P-580194839 | 98 | As is | in stock |
| P-895932779 | 95 | As is | by resynthesis (? - ? days) |
| P-864206139 | 95 | As is | in stock |
| P-864151388 | 98 | As is | in stock |
| P-901559033 | 95 | As is | by synthesis |
| P-893226930 | 95 | As is | in stock |
| P-580452615 | 98 | As is | in stock |
| P-889114889 | 97 | As is | 258.75 g |
| P-905430109 | 98 | As is | 387 g |
| P-905359323 | 98 | As is | 387 g |
| P-494300313 | 98 | As is | in stock |
| P-500418788 | 98 | As is | in stock |
| P-854062765 | 90 | As is | in stock |
| P-855933817 | 97 | As is | 500 g |
| P-856040478 | 90 | As is | 10 g |
| P-31275118 | 90 | As is | 10 g |
| P-613282538 | 95 | As is | by synthesis |
| P-613332672 | 95 | As is | by synthesis |
| P-617711330 | 90 | As is | 6.2 g |
| P-424432364 | 90 | As is | 6.2 g |
| P-868099467 | 92 | As is | in stock |
| P-885534338 | 95 | As is | by synthesis |
| P-18934288 | 90 | As is | in stock |
| P-579711088 | N/A | As is | in stock |
| P-904255991 | 95 | As is | in stock |
| P-464623437 | 95 | As is | by synthesis |
| P-892286504 | 95 | As is | 1.516 g |
| P-892310034 | 95 | As is | 1.516 g |
| P-502332427 | 90 | As is | in stock |
| P-611504339 | 90 | As is | in stock |
| P-464413 | 90 | As is | 102 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 144.125 |
| logP | -0.1114 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 52.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 33.052 |
| Atoms | 18 |
| Rings | 0 |
| Heavy atoms | 10 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |

