Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1584859167
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-4557072285
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1584859167.sdf |
| SMILES | MCULE-1584859167.smiles |
| Standard InChI | MCULE-1584859167.inchi |
| InChIKey | MCULE-1584859167.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886541588 | 95 | As is | in stock |
| P-889905096 | N/A | As is | by synthesis |
| P-613856017 | 95 | As is | in stock |
| P-903048143 | 95 | As is | 5 g |
| P-489239395 | 97 | As is | in stock |
| P-889811335 | 95 | As is | by synthesis |
| P-504708077 | 85 | As is | 5 mg |
| P-454754926 | 90 | As is | in stock |
| P-454696662 | 90 | As is | in stock |
| P-436448070 | 95 | As is | 9 g |
| P-20013165 | 90 | As is | in stock |
| P-861528815 | 95 | As is | by synthesis |
| P-34801983 | 90 | As is | in stock |
| P-872921017 | 90 | As is | by resynthesis (? - ? days) |
| P-605203206 | 90 | As is | in stock |
| P-889112036 | 95 | As is | 1.9 g |
| P-502530215 | 95 | As is | by synthesis |
| P-675477689 | 90 | As is | in stock |
| P-675513932 | 95 | As is | in stock |
| P-454304372 | 90 | As is | unavailable |
| P-580509312 | 95 | As is | by synthesis |
| P-852398257 | N/A | As is | in stock |
| P-895685990 | 95 | As is | by synthesis |
| P-492279479 | 95 | As is | 1000 mg |
| P-424114680 | 90 | As is | 70 mg |
| P-856063747 | 95 | As is | in stock |
| P-23885120 | 90 | As is | in stock |
| P-33464981 | 90 | As is | in stock |
| P-502341642 | 90 | As is | in stock |
| P-888492200 | 94 | As is | by resynthesis (? - ? days) |
| P-611426408 | 90 | As is | in stock |
| P-886937797 | 95 | As is | by synthesis |
| P-892872344 | 95 | As a main component | in stock |
| P-889949453 | N/A | As a main component | by synthesis |
| P-903215434 | 95 | As a main component | 500 mg |
| P-889810015 | 95 | As a main component | by synthesis |
| P-616227451 | 95 | As a main component | in stock |
| P-4149674 | 90 | As a main component | 100 mg |
| P-619850808 | 90 | As a main component | 42 mg |
| P-861376894 | 95 | As a main component | by synthesis |
| P-861298246 | 90 | As a main component | in stock |
| P-580788858 | 90 | As a main component | by resynthesis (? - ? days) |
| P-580773409 | 90 | As a main component | in stock |
| P-579804192 | 90 | As a main component | in stock |
| P-580089591 | 95 | As a main component | 630 mg |
| P-870569041 | 90 | As a main component | in stock |
| P-870580240 | 95 | As a main component | in stock |
| P-488552882 | 90 | As a main component | in stock |
| P-24445574 | 95 | As a main component | 300 mg |
| P-895703085 | 95 | As a main component | by synthesis |
| P-617666136 | 90 | As a main component | 630 mg |
| P-620221369 | 95 | As a main component | 630 mg |
| P-454370136 | 92 | As a main component | in stock |
| P-674648443 | 92 | As a main component | 300 mg |
| P-855215592 | 90 | As a main component | in stock |
| P-893881420 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 201.267 |
| logP | 2.7116 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 43.84 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 62.3124 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
