MCULE-6683313473
- 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 | 30 USD | 95 | 7 working days | Get Quote |
| 5 mg | 69 USD | 95 | 7 working days | Get Quote |
| 10 mg | 101 USD | 95 | 7 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-3055256110
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6683313473.sdf |
| SMILES | MCULE-6683313473.smiles |
| Standard InChI | MCULE-6683313473.inchi |
| InChIKey | MCULE-6683313473.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867617832 | 98 | As is | in stock |
| P-875779044 | N/A | As is | in stock |
| P-874601885 | 98 | As is | in stock |
| P-903122516 | 95 | As is | 200 mg |
| P-893507872 | 90 | As is | 9.539 g |
| P-891664647 | N/A | As is | by synthesis |
| P-895097498 | 98 | As is | unavailable |
| P-864318661 | 95 | As is | by synthesis |
| P-901910495 | 97 | As is | by synthesis |
| P-887199897 | 95 | As is | by synthesis |
| P-888626372 | 95 | As is | 100 mg |
| P-895894916 | 95 | As is | in stock |
| P-872674854 | 95 | As is | in stock |
| P-878642649 | 98 | As is | in stock |
| P-869175032 | 95 | As is | by synthesis |
| P-904255736 | 95 | As is | 397 mg |
| P-888664809 | 95 | As is | 397 mg |
| P-868497844 | 95 | As is | in stock |
| P-867693350 | 99 | As a main component | in stock |
| P-875873197 | N/A | As a main component | in stock |
| P-874639883 | N/A | As a main component | in stock |
| P-903366737 | 98 | As a main component | 40 mg |
| P-893544342 | 90 | As a main component | 5.403 g |
| P-891662470 | N/A | As a main component | by synthesis |
| P-888829560 | 98 | As a main component | 40 mg |
| P-889796125 | 95 | As a main component | by synthesis |
| P-901904542 | 98 | As a main component | by synthesis |
| P-901558521 | 95 | As a main component | by synthesis |
| P-887189229 | 95 | As a main component | by synthesis |
| P-873250245 | 97 | As a main component | 10 mg |
| P-854712561 | 95 | As a main component | in stock |
| P-869110802 | 95 | As a main component | by synthesis |
| P-904244565 | 95 | As a main component | unavailable |
| P-888628950 | 95 | As a main component | 5 mg |
| P-868537074 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 488.538 |
| logP | 5.9116 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 8 |
| PSA | 146.33 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 136.5916 |
| Atoms | 56 |
| Rings | 5 |
| Heavy atoms | 35 |
| Hydrogen atoms | 21 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| 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 |

