MCULE-2673170834
- 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 | 6 USD | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 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-2673170834.sdf |
| SMILES | MCULE-2673170834.smiles |
| Standard InChI | MCULE-2673170834.inchi |
| InChIKey | MCULE-2673170834.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867659887 | 97 | As is | in stock |
| P-875828274 | N/A | As is | in stock |
| P-869186542 | 95 | As is | in stock |
| P-505397991 | 98 | As is | in stock |
| P-903203285 | 97 | As is | 175 g |
| P-905488287 | 97 | As is | 10 g |
| P-893519607 | 90 | As is | 3.14045 kg |
| P-580244788 | 95 | As is | by synthesis |
| P-606856356 | N/A | As is | in stock |
| P-489144369 | 97 | As is | in stock |
| P-596972059 | 97 | As is | 1000 g |
| P-589660608 | 95 | As is | by resynthesis (? - ? days) |
| P-864104377 | 95 | As is | in stock |
| P-580703046 | 97 | As is | 131.25 g |
| P-868601369 | 98 | As is | in stock |
| P-580437180 | 95 | As is | by resynthesis (? - ? days) |
| P-862011537 | 95 | As is | 2.23668 kg |
| P-905341003 | 95 | As is | 125 g |
| P-505535926 | 95 | As is | in stock |
| P-13877181 | 90 | As is | in stock |
| P-13846232 | 95 | As is | 300 mg |
| P-855996722 | 95 | As is | 100 mg |
| P-454421889 | 95 | As is | 100 g |
| P-579617497 | 97 | As is | 155 g |
| P-895995691 | 95 | As is | by synthesis |
| P-852488509 | N/A | As is | in stock |
| P-454373847 | 92 | As is | in stock |
| P-14028812 | 92 | As is | 300 mg |
| P-500410958 | 98 | As is | by synthesis |
| P-885529351 | 95 | As is | by synthesis |
| P-605214280 | 90 | As is | in stock |
| P-873222357 | 90 | As is | in stock |
| P-906898936 | 97 | As is | in stock |
| P-611488065 | 90 | As is | in stock |
| P-611482745 | 90 | As is | in stock |
| P-25729446 | 90 | As is | 1.004 g |
| P-464683249 | 90 | As is | 1.004 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.210 |
| logP | 1.86708 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 42.25 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 51.8 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

