Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1125275077
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 | 17 USD | 96 | 14 working days | Get Quote |
| 5 mg | 17 USD | 96 | 14 working days | Get Quote |
| 10 mg | 17 USD | 96 | 14 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-6904860180
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1125275077.sdf |
| SMILES | MCULE-1125275077.smiles |
| Standard InChI | MCULE-1125275077.inchi |
| InChIKey | MCULE-1125275077.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867412645 | N/A | As is | by synthesis |
| P-904065954 | 95 | As is | by synthesis |
| P-892266061 | 95 | As is | by synthesis |
| P-892346334 | 95 | As is | unavailable |
| P-867565727 | 98 | As a main component | in stock |
| P-875725275 | N/A | As a main component | in stock |
| P-881661129 | 95 | As a main component | in stock |
| P-590416916 | 98 | As a main component | in stock |
| P-903054093 | 96 | As a main component | 100 g |
| P-875896525 | N/A | As a main component | in stock |
| P-851455299 | N/A | As a main component | by synthesis |
| P-489205207 | 97 | As a main component | in stock |
| P-596987491 | 96 | As a main component | 25 g |
| P-895929949 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864188091 | 95 | As a main component | in stock |
| P-590752506 | 96 | As a main component | by synthesis |
| P-868608185 | 98 | As a main component | in stock |
| P-488545741 | 90 | As a main component | in stock |
| P-24172850 | 95 | As a main component | 300 mg |
| P-596573614 | 97 | As a main component | 25 g |
| P-852426821 | N/A | As a main component | in stock |
| P-854714974 | 95 | As a main component | in stock |
| P-871067766 | 95 | As a main component | in stock |
| P-888174410 | 98 | As a main component | by synthesis |
| P-454370599 | 92 | As a main component | in stock |
| P-13267546 | 92 | As a main component | 300 mg |
| P-885546384 | 95 | As a main component | by synthesis |
| P-889853033 | 95 | As a main component | by synthesis |
| P-617402891 | N/A | As a main component | in stock |
| P-896073112 | N/A | As a main component | 67.937 g |
| P-896080283 | N/A | As a main component | 2.324 g |
| P-869159383 | 95 | As a main component | by synthesis |
| P-892294060 | 95 | As a main component | 502 mg |
| P-888654953 | 95 | As a main component | 502 mg |
| P-502385786 | 90 | As a main component | in stock |
| P-906774678 | 96 | As a main component | by synthesis |
| P-617771678 | 90 | As a main component | 1.019 g |
| P-617724202 | 90 | As a main component | 1.019 g |
| P-615404162 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 259.772 |
| logP | 3.9276 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 3.24 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 78.008 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 18 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
