Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4456423689
Compound
Show structures
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 | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 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.
-
MCULE-3927948933
- Component type: Unknown
-
MCULE-4856090143
- Component type: Main
-
MCULE-8178333530
- Component type: Main
-
MCULE-3474372269
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4456423689.sdf |
| SMILES | MCULE-4456423689.smiles |
| Standard InChI | MCULE-4456423689.inchi |
| InChIKey | MCULE-4456423689.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867571675 | 98 | As is | in stock |
| P-867596080 | 98 | As is | in stock |
| P-1275160074 | 98 | As is | in stock |
| P-1275152399 | 95 | As is | in stock |
| P-1275174204 | 99 | As is | in stock |
| P-853433772 | 95 | As is | by resynthesis (? - ? days) |
| P-1270386822 | 98 | As is | in stock |
| P-606872270 | N/A | As is | in stock |
| P-596932054 | 98 | As is | 3 kg |
| P-597005806 | 98 | As is | 3 kg |
| P-596659464 | 95 | As is | 292.29 g |
| P-1273455693 | 95 | As is | by resynthesis (? - ? days) |
| P-889781311 | 95 | As is | in stock |
| P-864147596 | 98 | As is | in stock |
| P-901417290 | 95 | As is | by synthesis |
| P-893233868 | 95 | As is | in stock |
| P-454626397 | 90 | As is | in stock |
| P-448676631 | 90 | As is | 50.295 g |
| P-436458244 | 95 | As is | in stock |
| P-425203533 | 90 | As is | in stock |
| P-19868075 | 90 | As is | in stock |
| P-34742248 | 90 | As is | by synthesis |
| P-889436959 | 98 | As is | 5.87518 kg |
| P-1273145387 | 95 | As is | 22 g |
| P-905359965 | 98 | As is | 650 g |
| P-862046045 | 95 | As is | 6.70582 kg |
| P-905348253 | 95 | As is | 200 g |
| P-870657563 | N/A | As is | in stock |
| P-870661777 | N/A | As is | in stock |
| P-579491387 | 90 | As is | 1.415 g |
| P-890207231 | 90 | As is | in stock |
| P-505491480 | 95 | As is | in stock |
| P-492214866 | 95 | As is | in stock |
| P-502760731 | 90 | As is | in stock |
| P-488544537 | 90 | As is | in stock |
| P-14013902 | 92 | As is | 300 mg |
| P-454407338 | 95 | As is | 192 mg |
| P-596548461 | 95 | As is | 100 mg |
| P-454329734 | 95 | As is | 192 mg |
| P-31149714 | 90 | As is | 10 g |
| P-856042748 | 90 | As is | 10 g |
| P-14228566 | 90 | As is | 210 mg |
| P-580514236 | 98 | As is | in stock |
| P-454364150 | 92 | As is | in stock |
| P-885515505 | 95 | As is | by synthesis |
| P-19202347 | 90 | As is | in stock |
| P-896077481 | N/A | As is | 47.558 g |
| P-904257454 | 95 | As is | in stock |
| P-869177854 | 95 | As is | in stock |
| P-892294737 | 95 | As is | unavailable |
| P-869160711 | 95 | As is | 89.909 g |
| P-594274953 | 95 | As is | 1000 mg |
| P-892296290 | 95 | As is | 1000 mg |
| P-888655956 | 95 | As is | 89.909 g |
| P-892338674 | 95 | As is | 1000 mg |
| P-502330408 | 90 | As is | in stock |
| P-33163664 | 90 | As is | 1000 mg |
| P-1272897049 | 94 | As is | by resynthesis (? - ? days) |
| P-906780735 | 98 | As is | by synthesis |
| P-906779529 | 99 | As is | by synthesis |
| P-611485264 | 90 | As is | in stock |
| P-855251827 | 90 | As is | in stock |
| P-3228983 | 90 | As is | 11.852 g |
| P-374361 | 90 | As is | 11.852 g |
| P-1271459254 | 95 | As is | by synthesis |
| P-1271634648 | 98 | As is | in stock |
| P-904028321 | N/A | As a main component | by synthesis |
| P-901462802 | 95 | As a main component | by synthesis |
| P-874599052 | 90 | As a main component | 2 mg |
| P-611485032 | 90 | As a main component | in stock |
| P-617778480 | 90 | As a main component | 3 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 178.184 |
| logP | 1.793 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 49.6038 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 1 |
| Undefined stereo double bonds | 0 |
