Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1919966850-0
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 | 7 USD | 98 | 22 working days | Get Quote |
| 5 mg | 7 USD | 98 | 22 working days | Get Quote |
| 10 mg | 7 USD | 98 | 22 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.
-
MCULE-8893931961-0
- Component type: Main
-
MCULE-6044803486-0
- Component type: Main
-
MCULE-3428379172-0
- Component type: Main
-
MCULE-3277368231-0
- Component type: Unknown
-
MCULE-9229158963-0
- Component type: Unknown
-
MCULE-3350305627-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1919966850-0.sdf |
| SMILES | MCULE-1919966850-0.smiles |
| Standard InChI | MCULE-1919966850-0.inchi |
| InChIKey | MCULE-1919966850-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867294232 | 98 | As is | by synthesis |
| P-901188304 | N/A | As is | by synthesis |
| P-903095373 | 98 | As is | 2 g |
| P-899960714 | N/A | As is | in stock |
| P-873291926 | 98 | As is | 2 g |
| P-901336486 | 95 | As is | in stock |
| P-901917106 | 95 | As is | 9.157 g |
| P-893624409 | 95 | As is | by synthesis |
| P-895219631 | 95 | As is | in stock |
| P-23115887 | 90 | As is | in stock |
| P-888440778 | 94 | As is | by resynthesis (? - ? days) |
| P-886970734 | 95 | As is | by synthesis |
| P-886899460 | 95 | As is | in stock |
| P-867585351 | 98 | As a main component | in stock |
| P-875743489 | N/A | As a main component | in stock |
| P-875745926 | N/A | As a main component | in stock |
| P-869184512 | 95 | As a main component | in stock |
| P-588247453 | 98 | As a main component | in stock |
| P-903073801 | 98 | As a main component | 3 kg |
| P-903076769 | 95 | As a main component | 3 kg |
| P-851938479 | N/A | As a main component | in stock |
| P-851944648 | N/A | As a main component | in stock |
| P-606935166 | N/A | As a main component | in stock |
| P-596988986 | 95 | As a main component | 4.5 kg |
| P-865909913 | 98 | As a main component | 4 kg |
| P-895928816 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864203348 | 95 | As a main component | in stock |
| P-615698632 | 98 | As a main component | 1000 g |
| P-868605026 | 98 | As a main component | in stock |
| P-868612965 | 98 | As a main component | in stock |
| P-868630521 | 98 | As a main component | in stock |
| P-870658817 | N/A | As a main component | in stock |
| P-596563291 | 97 | As a main component | 500 g |
| P-31256954 | 90 | As a main component | 5 g |
| P-872793213 | 95 | As a main component | by synthesis |
| P-901140235 | 95 | As a main component | by synthesis |
| P-895744456 | 95 | As a main component | by synthesis |
| P-500410021 | 98 | As a main component | by synthesis |
| P-33254875 | 90 | As a main component | in stock |
| P-906775322 | 98 | As a main component | by synthesis |
| P-906761862 | 99 | As a main component | by synthesis |
| P-893992114 | 95 | As a main component | in stock |
| P-33278097 | 90 | As a component | in stock |
| P-33278120 | 90 | As a component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 102.096 |
| logP | 0.4394 |
| H-bond acceptors | 5 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 104.99 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 24.1242 |
| Atoms | 13 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
