Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4027175053
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 | 6 USD | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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-2994351160
- Component type: Main
-
MCULE-5222132405
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4027175053.sdf |
| SMILES | MCULE-4027175053.smiles |
| Standard InChI | MCULE-4027175053.inchi |
| InChIKey | MCULE-4027175053.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867589469 | 98 | As is | in stock |
| P-875748899 | N/A | As is | in stock |
| P-869186241 | 95 | As is | in stock |
| P-505353905 | 98 | As is | in stock |
| P-505389236 | 99 | As is | in stock |
| P-869202301 | 95 | As is | in stock |
| P-903079796 | 98 | As is | 800 g |
| P-610957090 | 90 | As is | 655.337 g |
| P-606946489 | N/A | As is | in stock |
| P-489181197 | 97 | As is | in stock |
| P-596955640 | 98 | As is | 500 g |
| P-580193811 | 98 | As is | in stock |
| P-864085831 | 97 | As is | in stock |
| P-900154545 | 95 | As is | in stock |
| P-868543935 | 99 | As is | in stock |
| P-900268240 | N/A | As is | by resynthesis (? - ? days) |
| P-893219418 | 95 | As is | in stock |
| P-893236737 | 95 | As is | in stock |
| P-505575127 | 98 | As is | in stock |
| P-454642507 | 90 | As is | in stock |
| P-425134718 | 90 | As is | in stock |
| P-851247259 | 95 | As is | by synthesis |
| P-860799606 | 98 | As is | in stock |
| P-580450393 | 99 | As is | in stock |
| P-868593467 | 98 | As is | in stock |
| P-580759980 | 90 | As is | in stock |
| P-579479155 | 95 | As is | in stock |
| P-905313310 | 97 | As is | 5 g |
| P-608220822 | 98 | As is | in stock |
| P-870661940 | N/A | As is | in stock |
| P-505495061 | 95 | As is | in stock |
| P-890851558 | 90 | As is | in stock |
| P-890849832 | 95 | As is | in stock |
| P-488555448 | 92 | As is | in stock |
| P-488555293 | 90 | As is | in stock |
| P-524441049 | 97 | As is | 944 mg |
| P-579616046 | 95 | As is | 500 g |
| P-889737160 | 95 | As is | 250 mg |
| P-611662703 | N/A | As is | 19 g |
| P-852482377 | N/A | As is | in stock |
| P-904062479 | 95 | As is | by synthesis |
| P-854718627 | 95 | As is | in stock |
| P-474026366 | 95 | As is | in stock |
| P-608269843 | 98 | As is | in stock |
| P-881188439 | 90 | As is | 50 mg |
| P-13815424 | 92 | As is | 300 mg |
| P-500400299 | 98 | As is | by synthesis |
| P-889870726 | 95 | As is | by synthesis |
| P-424851337 | 90 | As is | in stock |
| P-579710302 | N/A | As is | in stock |
| P-869107789 | 95 | As is | by synthesis |
| P-892286386 | 95 | As is | 392 mg |
| P-888626826 | 95 | As is | 392 mg |
| P-611493126 | 90 | As is | in stock |
| P-611429314 | 90 | As is | in stock |
| P-2069826 | 90 | As is | 886 mg |
| P-885910896 | 98 | As a main component | by synthesis |
| P-885910897 | 98 | As a main component | by synthesis |
| P-851632144 | N/A | As a main component | by synthesis |
| P-851812872 | N/A | As a main component | by synthesis |
| P-590849131 | 98 | As a main component | by synthesis |
| P-591116636 | 98 | As a main component | by synthesis |
| P-901525668 | 95 | As a main component | by synthesis |
| P-901525669 | 95 | As a main component | by synthesis |
| P-608495590 | 95 | As a main component | in stock |
| P-608495591 | 95 | As a main component | in stock |
| P-854695473 | 95 | As a main component | by synthesis |
| P-854695827 | 95 | As a main component | by synthesis |
| P-888171050 | 98 | As a main component | by synthesis |
| P-888171051 | 98 | As a main component | by synthesis |
| P-869107790 | 95 | As a main component | by synthesis |
| P-892258075 | 95 | As a main component | by synthesis |
| P-892341036 | 95 | As a main component | unavailable |
| P-888626827 | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 410.484 |
| logP | 3.5283 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 64.16 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 117.708 |
| Atoms | 57 |
| Rings | 5 |
| Heavy atoms | 30 |
| Hydrogen atoms | 27 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
