Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1188726875-0
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 | 97 | 20 working days | Get Quote |
| 5 mg | 9 USD | 97 | 20 working days | Get Quote |
| 10 mg | 9 USD | 97 | 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-1188726875-0.sdf |
| SMILES | MCULE-1188726875-0.smiles |
| Standard InChI | MCULE-1188726875-0.inchi |
| InChIKey | MCULE-1188726875-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867534978 | 96 | As is | in stock |
| P-875689966 | N/A | As is | in stock |
| P-590401236 | 95 | As is | in stock |
| P-903010225 | 97 | As is | 25 g |
| P-893512795 | 90 | As is | 1.42196 kg |
| P-606865004 | N/A | As is | in stock |
| P-489233662 | 97 | As is | in stock |
| P-596935904 | 97 | As is | 400 g |
| P-494348493 | 95 | As is | 4.93 g |
| P-864151488 | 90 | As is | in stock |
| P-481169773 | 95 | As is | 118 g |
| P-584630168 | 96 | As is | 6 g |
| P-454680094 | 90 | As is | in stock |
| P-15145847 | 90 | As is | 15 mg |
| P-436441387 | 90 | As is | 8.94 g |
| P-307832 | 90 | As is | 997 mg |
| P-436472908 | 95 | As is | in stock |
| P-851271804 | 95 | As is | by synthesis |
| P-861279136 | 95 | As is | in stock |
| P-868571760 | 98 | As is | in stock |
| P-34719818 | 90 | As is | by synthesis |
| P-580786552 | 90 | As is | by resynthesis (? - ? days) |
| P-580423362 | 95 | As is | by resynthesis (? - ? days) |
| P-905335829 | 97 | As is | 1000 mg |
| P-861979853 | 97 | As is | 198.941 g |
| P-502459649 | 95 | As is | by synthesis |
| P-502788465 | 90 | As is | in stock |
| P-492221313 | 95 | As is | in stock |
| P-488547732 | 90 | As is | in stock |
| P-13613157 | 95 | As is | 300 mg |
| P-18796294 | 95 | As is | 22.524 g |
| P-454386230 | 95 | As is | 22.524 g |
| P-579659689 | 95 | As is | by resynthesis (? - ? days) |
| P-601063191 | 90 | As is | 162 mg |
| P-14057017 | 95 | As is | 162 mg |
| P-580465051 | 95 | As is | by synthesis |
| P-852413147 | N/A | As is | in stock |
| P-519752853 | 97 | As is | 49.39 g |
| P-428012614 | 97 | As is | 49.39 kg |
| P-863699399 | 95 | As is | in stock |
| P-26369447 | 90 | As is | 80 mg |
| P-454367461 | 92 | As is | in stock |
| P-13865801 | 92 | As is | 300 mg |
| P-500384518 | 95 | As is | by synthesis |
| P-856064050 | 95 | As is | in stock |
| P-424816286 | 90 | As is | in stock |
| P-596746967 | 96 | As is | 37.25 g |
| P-33438871 | 90 | As is | in stock |
| P-502336228 | 90 | As is | in stock |
| P-907284542 | 94 | As is | by resynthesis (? - ? days) |
| P-611385482 | 90 | As is | in stock |
| P-580448612 | 97 | As is | in stock |
| P-1048764 | 90 | As is | 1.214 g |
| P-3228864 | 90 | As is | 1.214 g |
| P-893981484 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.037 |
| logP | 2.8935 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 50.44 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.8733 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
