Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7593541473
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 | 17 USD | 98 | 14 working days | Get Quote |
| 5 mg | 22 USD | 98 | 8 working days | Get Quote |
| 10 mg | 37 USD | 98 | 8 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-8215122579
- Component type: Main
-
MCULE-1737070182
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7593541473.sdf |
| SMILES | MCULE-7593541473.smiles |
| Standard InChI | MCULE-7593541473.inchi |
| InChIKey | MCULE-7593541473.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867616697 | 98 | As is | in stock |
| P-875777843 | 98 | As is | in stock |
| P-892791511 | 95 | As is | by resynthesis (? - ? days) |
| P-1264055011 | 98 | As is | in stock |
| P-893509266 | 90 | As is | 2.694 g |
| P-1270297173 | 98 | As is | in stock |
| P-851931682 | N/A | As is | in stock |
| P-865915973 | 98 | As is | 100 mg |
| P-1273258048 | 95 | As is | by resynthesis (? - ? days) |
| P-869387983 | 95 | As is | in stock |
| P-608390354 | 98 | As is | 84 mg |
| P-901545534 | 95 | As is | by synthesis |
| P-861380681 | 98 | As is | by synthesis |
| P-868658686 | 95 | As is | in stock |
| P-888623085 | 95 | As is | 1 mg |
| P-895181906 | 95 | As is | in stock |
| P-871068429 | 95 | As is | in stock |
| P-878640634 | 98 | As is | in stock |
| P-892294843 | 95 | As is | unavailable |
| P-869160837 | 95 | As is | 104 mg |
| P-888656064 | 95 | As is | 98 mg |
| P-855107151 | 90 | As is | in stock |
| P-867616698 | 98 | As a main component | in stock |
| P-875777844 | 98 | As a main component | in stock |
| P-869350364 | 95 | As a main component | by resynthesis (? - ? days) |
| P-903120949 | 98 | As a main component | 3 g |
| P-1264053191 | 99 | As a main component | in stock |
| P-610989841 | 90 | As a main component | 11.171 g |
| P-1270340758 | 98 | As a main component | in stock |
| P-606859944 | N/A | As a main component | in stock |
| P-596963818 | 98 | As a main component | 1000 mg |
| P-1273255213 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273298838 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864173842 | 98 | As a main component | in stock |
| P-580726782 | 98 | As a main component | 330 mg |
| P-901546409 | 95 | As a main component | by synthesis |
| P-860799689 | 98 | As a main component | in stock |
| P-861368552 | 95 | As a main component | by synthesis |
| P-579481950 | 95 | As a main component | in stock |
| P-1273141401 | 98 | As a main component | 3 g |
| P-855924240 | 97 | As a main component | 100 mg |
| P-895181907 | 95 | As a main component | in stock |
| P-905146342 | 95 | As a main component | by synthesis |
| P-584618278 | 95 | As a main component | in stock |
| P-878640676 | 98 | As a main component | in stock |
| P-617403990 | 98 | As a main component | in stock |
| P-892294672 | 95 | As a main component | unavailable |
| P-869160559 | 95 | As a main component | 155 mg |
| P-888655822 | 95 | As a main component | 155 mg |
| P-906797387 | 98 | As a main component | by synthesis |
| P-1271674993 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 449.584 |
| logP | 5.1 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 11 |
| PSA | 50.97 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 139.507 |
| Atoms | 68 |
| Rings | 5 |
| Heavy atoms | 33 |
| Hydrogen atoms | 35 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
