MCULE-8601847811-0
- 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 | 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.
-
MCULE-3958107347-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8601847811-0.sdf |
| SMILES | MCULE-8601847811-0.smiles |
| Standard InChI | MCULE-8601847811-0.inchi |
| InChIKey | MCULE-8601847811-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564891 | 98 | As is | in stock |
| P-875723824 | N/A | As is | in stock |
| P-869190807 | 95 | As is | in stock |
| P-505395219 | 98 | As is | in stock |
| P-903052886 | 98 | As is | 614 g |
| P-905478759 | 95 | As is | 10 g |
| P-866099571 | 95 | As is | 19.3 g |
| P-901167659 | 97 | As is | in stock |
| P-580237376 | 95 | As is | by synthesis |
| P-606891684 | N/A | As is | in stock |
| P-489160305 | 97 | As is | in stock |
| P-489168368 | 97 | As is | in stock |
| P-596928618 | 98 | As is | 589 g |
| P-494344920 | 95 | As is | 1.5 g |
| P-864089226 | 97 | As is | in stock |
| P-481169738 | 95 | As is | 2 g |
| P-580720934 | 98 | As is | 642 g |
| P-504695562 | 85 | As is | 5 mg |
| P-454680774 | 90 | As is | in stock |
| P-584562344 | 90 | As is | 21 mg |
| P-436441625 | 90 | As is | 23.36 g |
| P-233536 | 90 | As is | 967 mg |
| P-517102463 | 90 | As is | in stock |
| P-878236123 | 95 | As is | by synthesis |
| P-861278766 | 95 | As is | in stock |
| P-868578172 | 98 | As is | in stock |
| P-34699758 | 90 | As is | in stock |
| P-580786794 | 90 | As is | by resynthesis (? - ? days) |
| P-580407571 | 95 | As is | by resynthesis (? - ? days) |
| P-861972999 | 95 | As is | 371.667 g |
| P-905334558 | 95 | As is | 56 g |
| P-890222868 | 90 | As is | in stock |
| P-871252182 | 90 | As is | 2.2 g |
| P-505526342 | 95 | As is | in stock |
| P-502455195 | 95 | As is | by synthesis |
| P-492214382 | 95 | As is | in stock |
| P-12429386 | 95 | As is | 294 mg |
| P-454296180 | 97 | As is | 7.706 g |
| P-454391168 | 97 | As is | 100 g |
| P-579633653 | 97 | As is | by resynthesis (? - ? days) |
| P-856015133 | 90 | As is | 250 mg |
| P-580480177 | 97 | As is | by synthesis |
| P-852441720 | N/A | As is | in stock |
| P-519750031 | 97 | As is | 370.8 g |
| P-35207210 | 97 | As is | 370.8 kg |
| P-854732211 | 95 | As is | in stock |
| P-26550708 | 90 | As is | 50 mg |
| P-888875702 | N/A | As is | in stock |
| P-500390022 | 97 | As is | by synthesis |
| P-491224923 | 95 | As is | by synthesis |
| P-19151504 | 90 | As is | in stock |
| P-23352651 | 90 | As is | 7 mg |
| P-596757402 | 98 | As is | 782 g |
| P-502336362 | 90 | As is | in stock |
| P-873036036 | 90 | As is | 49 mg |
| P-852027460 | 90 | As is | 214 mg |
| P-615393031 | 95 | As is | in stock |
| P-675345731 | 90 | As a main component | in stock |
| P-907296030 | 94 | As a main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 204.635 |
| logP | 1.5501 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 88.38 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 45.7223 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 5 |
| Heteroatoms | 6 |
| 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 |

