Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5507778018
Compound
Show structure
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 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.
| Name | File |
|---|---|
| SDF | MCULE-5507778018.sdf |
| SMILES | MCULE-5507778018.smiles |
| Standard InChI | MCULE-5507778018.inchi |
| InChIKey | MCULE-5507778018.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867556440 | 98 | As is | in stock |
| P-875715543 | 98 | As is | in stock |
| P-597024660 | 95 | As is | unavailable |
| P-590390562 | 95 | As is | by resynthesis (? - ? days) |
| P-903042970 | 98 | As is | 50 g |
| P-1270340179 | 98 | As is | in stock |
| P-580240477 | 95 | As is | by synthesis |
| P-606929600 | N/A | As is | in stock |
| P-489151662 | 97 | As is | in stock |
| P-596943576 | 97 | As is | 50 g |
| P-596651592 | 95 | As is | by resynthesis (? - ? days) |
| P-864103126 | 95 | As is | in stock |
| P-580716336 | 98 | As is | 26.25 g |
| P-851290352 | 95 | As is | by synthesis |
| P-861269712 | 95 | As is | in stock |
| P-868572422 | 98 | As is | in stock |
| P-580299317 | 95 | As is | by resynthesis (? - ? days) |
| P-861983257 | 97 | As is | 152.225 g |
| P-905336116 | 97 | As is | 40 g |
| P-505495383 | 95 | As is | in stock |
| P-500155470 | 96 | As is | in stock |
| P-454409959 | 95 | As is | 2.529 g |
| P-18801680 | 95 | As is | 2.529 g |
| P-579694560 | 95 | As is | by resynthesis (? - ? days) |
| P-852413952 | N/A | As is | by synthesis |
| P-1272572888 | N/A | As is | in stock |
| P-854747750 | 95 | As is | in stock |
| P-492283037 | 95 | As is | 1.529 g |
| P-34045771 | 90 | As is | 1.529 g |
| P-889876358 | 95 | As is | by synthesis |
| P-596756054 | 97 | As is | 279.2 g |
| P-502362644 | 90 | As is | in stock |
| P-906902255 | 98 | As is | in stock |
| P-611386436 | 90 | As is | in stock |
| P-615647049 | 95 | As is | unavailable |
| P-1279111413 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 167.590 |
| logP | 1.9726 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 29.1 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.7447 |
| Atoms | 17 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
