Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5055747072
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-8167843508
- Component type: Main
-
MCULE-2981124931
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5055747072.sdf |
| SMILES | MCULE-5055747072.smiles |
| Standard InChI | MCULE-5055747072.inchi |
| InChIKey | MCULE-5055747072.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867595686 | 95 | As is | in stock |
| P-852178456 | N/A | As is | by synthesis |
| P-875754499 | N/A | As is | in stock |
| P-615722956 | 95 | As is | in stock |
| P-903088516 | 95 | As is | 2.5 g |
| P-596518301 | 90 | As is | unavailable |
| P-864258948 | 95 | As is | by synthesis |
| P-901565015 | 95 | As is | by synthesis |
| P-851241092 | 95 | As is | by synthesis |
| P-861272015 | 95 | As is | in stock |
| P-580388420 | N/A | As is | by resynthesis (? - ? days) |
| P-590338574 | 90 | As is | 1000 mg |
| P-890216139 | 90 | As is | in stock |
| P-454322531 | 90 | As is | unavailable |
| P-613279308 | 95 | As is | by synthesis |
| P-852450649 | N/A | As is | in stock |
| P-854890169 | 95 | As is | by synthesis |
| P-492285975 | 95 | As is | 527 mg |
| P-12961657 | 90 | As is | 527 mg |
| P-903644638 | 94 | As is | by resynthesis (? - ? days) |
| P-611570539 | 90 | As is | in stock |
| P-893666847 | 95 | As is | by synthesis |
| P-854669320 | 95 | As is | in stock |
| P-867646338 | N/A | As a main component | in stock |
| P-901276497 | N/A | As a main component | in stock |
| P-590357976 | 95 | As a main component | in stock |
| P-874644563 | 97 | As a main component | in stock |
| P-851636405 | N/A | As a main component | by synthesis |
| P-851766561 | N/A | As a main component | by synthesis |
| P-892495309 | 90 | As a main component | 1000 mg |
| P-864120758 | 95 | As a main component | in stock |
| P-864194231 | 95 | As a main component | in stock |
| P-590966127 | 95 | As a main component | by synthesis |
| P-591039694 | 95 | As a main component | by synthesis |
| P-901420690 | 95 | As a main component | by synthesis |
| P-901438405 | 95 | As a main component | by synthesis |
| P-617648757 | 90 | As a main component | in stock |
| P-861385377 | 95 | As a main component | by synthesis |
| P-861557441 | 95 | As a main component | by synthesis |
| P-580286961 | N/A | As a main component | by resynthesis (? - ? days) |
| P-864498948 | 90 | As a main component | in stock |
| P-569206522 | 90 | As a main component | in stock |
| P-864499076 | 90 | As a main component | in stock |
| P-666730619 | 90 | As a main component | in stock |
| P-864498555 | 90 | As a main component | in stock |
| P-864498044 | 90 | As a main component | in stock |
| P-864498565 | 90 | As a main component | in stock |
| P-579803113 | 90 | As a main component | in stock |
| P-864498414 | 90 | As a main component | in stock |
| P-569434996 | 95 | As a main component | 12.38 g |
| P-675252307 | 95 | As a main component | by synthesis |
| P-675354897 | 90 | As a main component | in stock |
| P-580044713 | 90 | As a main component | in stock |
| P-675485644 | 95 | As a main component | in stock |
| P-492242412 | 95 | As a main component | in stock |
| P-492242512 | 95 | As a main component | in stock |
| P-488546238 | 90 | As a main component | in stock |
| P-24348504 | 92 | As a main component | 300 mg |
| P-579453282 | 97 | As a main component | 5 g |
| P-563394670 | 97 | As a main component | 1000 mg |
| P-596575945 | 95 | As a main component | 1000 mg |
| P-855959550 | 97 | As a main component | 5 g |
| P-615645761 | 95 | As a main component | in stock |
| P-852380511 | N/A | As a main component | in stock |
| P-854774919 | 95 | As a main component | by synthesis |
| P-854864633 | 95 | As a main component | by synthesis |
| P-34037557 | 90 | As a main component | 12.38 g |
| P-26368105 | 90 | As a main component | 1 mg |
| P-492281807 | 95 | As a main component | 12.38 g |
| P-454370760 | 92 | As a main component | in stock |
| P-13713427 | 92 | As a main component | 300 mg |
| P-445293527 | 92 | As a main component | 300 mg |
| P-889875896 | 95 | As a main component | by synthesis |
| P-873214531 | 90 | As a main component | in stock |
| P-903642194 | 94 | As a main component | by resynthesis (? - ? days) |
| P-611591902 | 90 | As a main component | in stock |
| P-617767342 | 90 | As a main component | 429 mg |
| P-893780930 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 161.204 |
| logP | 2.2829 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 54.7 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.5741 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 12 |
| 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 |
