Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1184803692-0
Structure
Show compound
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-1184803692-0.sdf |
| SMILES | MCULE-1184803692-0.smiles |
| Standard InChI | MCULE-1184803692-0.inchi |
| InChIKey | MCULE-1184803692-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586292 | 98 | As is | in stock |
| P-867661376 | 98 | As is | in stock |
| P-852188496 | N/A | As is | by synthesis |
| P-869187735 | 95 | As is | in stock |
| P-611623457 | 97 | As is | in stock |
| P-505388387 | 98 | As is | in stock |
| P-869212795 | 99 | As is | in stock |
| P-580247623 | 95 | As is | by synthesis |
| P-851810262 | N/A | As is | by synthesis |
| P-872714051 | N/A | As is | in stock |
| P-596984130 | 98 | As is | 200 g |
| P-596972641 | 98 | As is | 300 g |
| P-580195023 | 98 | As is | in stock |
| P-869391926 | 95 | As is | in stock |
| P-864192093 | 95 | As is | in stock |
| P-868545723 | 99 | As is | in stock |
| P-34909865 | 90 | As is | in stock |
| P-579477404 | 95 | As is | in stock |
| P-905319829 | 95 | As is | in stock |
| P-870661016 | N/A | As is | in stock |
| P-870661350 | N/A | As is | in stock |
| P-488556128 | 92 | As is | in stock |
| P-856005801 | 90 | As is | 974 mg |
| P-855983973 | 97 | As is | 1000 mg |
| P-31162355 | 90 | As is | unavailable |
| P-888841508 | N/A | As is | by synthesis |
| P-500392371 | 98 | As is | by synthesis |
| P-885538339 | 95 | As is | by synthesis |
| P-19531851 | 90 | As is | in stock |
| P-579710490 | N/A | As is | in stock |
| P-869111600 | 95 | As is | by synthesis |
| P-892287832 | 95 | As is | 514 mg |
| P-888629475 | 95 | As is | 514 mg |
| P-502335793 | 90 | As is | in stock |
| P-33162792 | 90 | As is | 1000 mg |
| P-854960407 | 90 | As is | in stock |
| P-854960444 | 90 | As is | in stock |
| P-1251609 | 90 | As is | 86 mg |
| P-480859548 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 268.349 |
| logP | 4.8286 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 40.46 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 85.086 |
| Atoms | 40 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 20 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
