Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5863470522
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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 52 USD | 95 | 20 working days | Get Quote |
| 10 mg | 52 USD | 95 | 20 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-7471386964
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5863470522.sdf |
| SMILES | MCULE-5863470522.smiles |
| Standard InChI | MCULE-5863470522.inchi |
| InChIKey | MCULE-5863470522.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867535760 | 95 | As is | in stock |
| P-875691125 | N/A | As is | in stock |
| P-890838365 | 97 | As is | in stock |
| P-595218198 | 95 | As is | in stock |
| P-903011928 | 95 | As is | 3 g |
| P-893490213 | 90 | As is | 199 g |
| P-868820562 | N/A | As is | in stock |
| P-489194912 | 97 | As is | in stock |
| P-596990488 | 95 | As is | 3 g |
| P-494407637 | 95 | As is | by resynthesis (? - ? days) |
| P-864090662 | 97 | As is | in stock |
| P-866715953 | 95 | As is | 1.675 g |
| P-494301036 | 95 | As is | in stock |
| P-577179351 | 90 | As is | by synthesis |
| P-851243713 | 95 | As is | by synthesis |
| P-861550876 | 95 | As is | by synthesis |
| P-580428272 | 95 | As is | by resynthesis (? - ? days) |
| P-675214831 | 95 | As is | in stock |
| P-502448814 | 95 | As is | by synthesis |
| P-454382505 | 95 | As is | 106.02 g |
| P-905626153 | 97 | As is | 100 g |
| P-905626059 | 97 | As is | 100 g |
| P-18805072 | 95 | As is | 106.02 g |
| P-579636049 | 95 | As is | by resynthesis (? - ? days) |
| P-588250066 | N/A | As is | by synthesis |
| P-852414393 | N/A | As is | in stock |
| P-854793974 | 95 | As is | by synthesis |
| P-885523182 | 95 | As is | by synthesis |
| P-23836346 | 90 | As is | in stock |
| P-502404675 | 90 | As is | in stock |
| P-611369547 | 90 | As is | in stock |
| P-3224600 | 90 | As is | 17.131 g |
| P-392429 | 90 | As is | 17.131 g |
| P-3242619 | 90 | As is | 17.131 g |
| P-666973524 | 95 | As is | in stock |
| P-524192614 | 97 | As a main component | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 234.076 |
| logP | 3.1682 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 55.5212 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
