MCULE-6287276672
- 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 | 25 USD | 98 | 16 working days | Get Quote |
| 5 mg | 40 USD | 98 | 16 working days | Get Quote |
| 10 mg | 66 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.
-
MCULE-4473708822
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6287276672.sdf |
| SMILES | MCULE-6287276672.smiles |
| Standard InChI | MCULE-6287276672.inchi |
| InChIKey | MCULE-6287276672.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867593161 | 95 | As is | in stock |
| P-875752071 | N/A | As is | in stock |
| P-1275199416 | 98 | As is | in stock |
| P-1264047161 | 99 | As is | in stock |
| P-610964191 | 90 | As is | 12.401 g |
| P-617049641 | 95 | As is | by resynthesis (? - ? days) |
| P-489113683 | 97 | As is | in stock |
| P-596956396 | 98 | As is | 500 mg |
| P-896023174 | 95 | As is | in stock |
| P-868544395 | 98 | As is | in stock |
| P-871222126 | N/A | As is | by resynthesis (? - ? days) |
| P-901420848 | 95 | As is | by synthesis |
| P-901458075 | 95 | As is | by synthesis |
| P-851242996 | 95 | As is | by synthesis |
| P-860798161 | 98 | As is | in stock |
| P-887228828 | 95 | As is | by synthesis |
| P-579478702 | 95 | As is | in stock |
| P-580377747 | N/A | As is | by resynthesis (? - ? days) |
| P-675215739 | 95 | As is | in stock |
| P-596561952 | 95 | As is | 16 mg |
| P-852465326 | 95 | As is | by synthesis |
| P-854713395 | 95 | As is | in stock |
| P-474027386 | 95 | As is | in stock |
| P-878640995 | 98 | As is | in stock |
| P-500410092 | 98 | As is | by synthesis |
| P-579711279 | 98 | As is | in stock |
| P-892292298 | 95 | As is | unavailable |
| P-869136394 | 95 | As is | 198 mg |
| P-888644753 | 95 | As is | 198 mg |
| P-615634099 | 95 | As is | unavailable |
| P-666984167 | 98 | As is | in stock |
| P-886759236 | 98 | As a main component | in stock |
| P-890188569 | 98 | As a main component | in stock |
| P-874650607 | N/A | As a main component | by resynthesis (? - ? days) |
| P-895111286 | N/A | As a main component | 100 mg |
| P-889795964 | 95 | As a main component | by synthesis |
| P-854715113 | 95 | As a main component | in stock |
| P-871076712 | 95 | As a main component | in stock |
| P-1271610607 | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 348.369 |
| logP | 4.3124 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 99.4568 |
| Atoms | 43 |
| Rings | 4 |
| Heavy atoms | 26 |
| Hydrogen atoms | 17 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |

