Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9781902479
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 | 7 USD | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 20 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.
-
1
MCULE-2428747136
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9781902479.sdf |
| SMILES | MCULE-9781902479.smiles |
| Standard InChI | MCULE-9781902479.inchi |
| InChIKey | MCULE-9781902479.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886520518 | 98 | As is | in stock |
| P-867621411 | 95 | As is | in stock |
| P-1275143069 | 95 | As is | in stock |
| P-1275177185 | 98 | As is | in stock |
| P-851691992 | N/A | As is | by synthesis |
| P-851888592 | N/A | As is | by synthesis |
| P-489177036 | 97 | As is | in stock |
| P-873293796 | 95 | As is | 10 g |
| P-1273295899 | 95 | As is | by resynthesis (? - ? days) |
| P-896026607 | 95 | As is | in stock |
| P-893235278 | 95 | As is | in stock |
| P-1272276958 | 95 | As is | by synthesis |
| P-505498144 | 95 | As is | in stock |
| P-524163094 | 98 | As is | 5 mg |
| P-500400372 | 99 | As is | by synthesis |
| P-617402707 | 98 | As is | in stock |
| P-855347890 | 90 | As is | in stock |
| P-855314422 | 90 | As is | in stock |
| P-1271659599 | 99 | As is | in stock |
| P-590435362 | 97 | As is | in stock |
| P-867662695 | 98 | Main component | in stock |
| P-1275181420 | 99 | Main component | in stock |
| P-1275179665 | 98 | Main component | in stock |
| P-1275143068 | 95 | Main component | in stock |
| P-580193236 | 98 | Main component | in stock |
| P-1270313222 | 98 | Main component | in stock |
| P-606922883 | N/A | Main component | in stock |
| P-596973201 | 98 | Main component | 200 g |
| P-1273291056 | 95 | Main component | by resynthesis (? - ? days) |
| P-1273283057 | 95 | Main component | by resynthesis (? - ? days) |
| P-1268583891 | 95 | Main component | by synthesis |
| P-864125677 | 97 | Main component | in stock |
| P-870652788 | N/A | Main component | in stock |
| P-505516938 | 95 | Main component | in stock |
| P-856009397 | 95 | Main component | 100 mg |
| P-500401149 | 99 | Main component | by synthesis |
| P-885547621 | 95 | Main component | by synthesis |
| P-579710999 | 98 | Main component | in stock |
| P-869161995 | 95 | Main component | 1.002 g |
| P-892296952 | 95 | Main component | 1.002 g |
| P-888657390 | 95 | Main component | 1.002 g |
| P-873222331 | 90 | Main component | in stock |
| P-906779472 | 98 | Main component | by synthesis |
| P-611521567 | 90 | Main component | in stock |
| P-611365578 | 90 | Main component | in stock |
| P-615650279 | 95 | Main component | unavailable |
| P-666968125 | 98 | Main component | in stock |
| P-867611522 | 97 | Main component as a main component | in stock |
| P-852184933 | N/A | Main component as a main component | by synthesis |
| P-1275182594 | 95 | Main component as a main component | in stock |
| P-580195057 | 98 | Main component as a main component | in stock |
| P-606907161 | N/A | Main component as a main component | in stock |
| P-596962654 | 97 | Main component as a main component | 5 g |
| P-1273453402 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-895930380 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-893219335 | 95 | Main component as a main component | in stock |
| P-893235245 | 95 | Main component as a main component | in stock |
| P-580451047 | 98 | Main component as a main component | in stock |
| P-862126611 | 97 | Main component as a main component | 2 g |
| P-1273110170 | 95 | Main component as a main component | 100 mg |
| P-500401133 | 99 | Main component as a main component | by synthesis |
| P-885547620 | 95 | Main component as a main component | by synthesis |
| P-579710640 | 98 | Main component as a main component | in stock |
| P-892297432 | 95 | Main component as a main component | unavailable |
| P-869162318 | 95 | Main component as a main component | 202 mg |
| P-888657694 | 95 | Main component as a main component | 202 mg |
| P-873223298 | 90 | Main component as a main component | in stock |
| P-906779184 | 99 | Main component as a main component | by synthesis |
| P-855344712 | 90 | Main component as a main component | in stock |
| P-855066563 | 90 | Main component as a main component | in stock |
| P-1271667091 | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 250.228 |
| logP | 0.6945 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 57.95 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 62.7035 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 11 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 1 |
| 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 | 1 |
| Undefined stereo double bonds | 0 |
