Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9586066336
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 | 3 USD | 98 | 14 working days | Get Quote |
| 5 mg | 3 USD | 98 | 14 working days | Get Quote |
| 10 mg | 3 USD | 98 | 14 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.
-
1
MCULE-3828251614
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9586066336.sdf |
| SMILES | MCULE-9586066336.smiles |
| Standard InChI | MCULE-9586066336.inchi |
| InChIKey | MCULE-9586066336.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893165682 | N/A | As is | by synthesis |
| P-867585619 | 95 | Main component | in stock |
| P-875743435 | N/A | Main component | in stock |
| P-590375525 | 95 | Main component | in stock |
| P-903074014 | 98 | Main component | 50 g |
| P-893512349 | 90 | Main component | 86.2 g |
| P-875895625 | N/A | Main component | in stock |
| P-1263087637 | N/A | Main component | by synthesis |
| P-489185408 | 97 | Main component | in stock |
| P-597009449 | 95 | Main component | 250 g |
| P-864109780 | 95 | Main component | in stock |
| P-889739925 | 95 | Main component | 20 g |
| P-605402547 | 95 | Main component | by synthesis |
| P-893223708 | 95 | Main component | in stock |
| P-868619455 | 98 | Main component | in stock |
| P-580427691 | 95 | Main component | by resynthesis (? - ? days) |
| P-905317511 | 95 | Main component | in stock |
| P-870658660 | 95 | Main component | in stock |
| P-454359026 | 90 | Main component | unavailable |
| P-856079434 | 98 | Main component | by resynthesis (? - ? days) |
| P-852510424 | N/A | Main component | in stock |
| P-863719498 | 95 | Main component | in stock |
| P-870921200 | 90 | Main component | 5.2 g |
| P-885546828 | 95 | Main component | by synthesis |
| P-424840312 | 90 | Main component | in stock |
| P-873285087 | N/A | Main component | in stock |
| P-906775910 | 98 | Main component | by synthesis |
| P-611377688 | 90 | Main component | in stock |
| P-893937759 | 95 | Main component | in stock |
| P-867564638 | 97 | Main component as a main component | in stock |
| P-867456680 | N/A | Main component as a main component | by synthesis |
| P-875724118 | N/A | Main component as a main component | in stock |
| P-597027896 | 95 | Main component as a main component | in stock |
| P-869184074 | 95 | Main component as a main component | in stock |
| P-505390848 | 98 | Main component as a main component | in stock |
| P-903053311 | 98 | Main component as a main component | 10 kg |
| P-580198955 | 95 | Main component as a main component | 5 g |
| P-606933957 | N/A | Main component as a main component | in stock |
| P-489164980 | 97 | Main component as a main component | in stock |
| P-596928714 | 98 | Main component as a main component | 50 kg |
| P-872728287 | 98 | Main component as a main component | in stock |
| P-552040488 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864116259 | 97 | Main component as a main component | in stock |
| P-481173289 | 95 | Main component as a main component | 83 g |
| P-860055895 | 97 | Main component as a main component | by synthesis |
| P-580707171 | 97 | Main component as a main component | 1.6 kg |
| P-893222750 | 95 | Main component as a main component | in stock |
| P-617653319 | 90 | Main component as a main component | by synthesis |
| P-584602558 | 95 | Main component as a main component | 10 g |
| P-868576872 | 98 | Main component as a main component | in stock |
| P-608495289 | 95 | Main component as a main component | in stock |
| P-580418494 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-862024794 | 95 | Main component as a main component | 15.4262 kg |
| P-905344633 | 95 | Main component as a main component | 50 g |
| P-505528694 | 95 | Main component as a main component | in stock |
| P-492244164 | 95 | Main component as a main component | in stock |
| P-675510900 | 95 | Main component as a main component | in stock |
| P-488550983 | 90 | Main component as a main component | in stock |
| P-856009817 | 90 | Main component as a main component | 164 mg |
| P-579617296 | 98 | Main component as a main component | 2 kg |
| P-31248462 | 90 | Main component as a main component | unavailable |
| P-666815800 | 95 | Main component as a main component | 193 mg |
| P-460495335 | 90 | Main component as a main component | 193 mg |
| P-852448854 | N/A | Main component as a main component | in stock |
| P-428002380 | 90 | Main component as a main component | 5.25 kg |
| P-1263154910 | 95 | Main component as a main component | by synthesis |
| P-854715083 | 95 | Main component as a main component | in stock |
| P-888172632 | 98 | Main component as a main component | by synthesis |
| P-492280373 | 95 | Main component as a main component | 500 mg |
| P-34031173 | 90 | Main component as a main component | 500 mg |
| P-454369225 | 92 | Main component as a main component | in stock |
| P-500402457 | 98 | Main component as a main component | by synthesis |
| P-885546827 | 95 | Main component as a main component | by synthesis |
| P-617402442 | N/A | Main component as a main component | in stock |
| P-896074013 | N/A | Main component as a main component | 6.662 g |
| P-869163488 | 95 | Main component as a main component | by synthesis |
| P-892299679 | 95 | Main component as a main component | unavailable |
| P-888658840 | 95 | Main component as a main component | 200 mg |
| P-502363167 | 90 | Main component as a main component | in stock |
| P-906761373 | 98 | Main component as a main component | by synthesis |
| P-611377689 | 90 | Main component as a main component | in stock |
| P-617716512 | 90 | Main component as a main component | 1.036 g |
| P-617780644 | 90 | Main component as a main component | 1.036 g |
| P-893647172 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 180.204 |
| logP | 1.8616 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 87.17 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 51.2059 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
