Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8007176625
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 |
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-3790818382
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8007176625.sdf |
| SMILES | MCULE-8007176625.smiles |
| Standard InChI | MCULE-8007176625.inchi |
| InChIKey | MCULE-8007176625.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852139826 | 98 | As is | by synthesis |
| P-580442187 | 95 | As is | by resynthesis (? - ? days) |
| P-870652762 | N/A | As is | in stock |
| P-613278717 | 95 | As is | by synthesis |
| P-902978195 | 95 | As is | by synthesis |
| P-867595836 | 97 | As a main component | in stock |
| P-875755236 | N/A | As a main component | in stock |
| P-869184408 | 95 | As a main component | in stock |
| P-505403838 | 99 | As a main component | in stock |
| P-505391205 | 98 | As a main component | in stock |
| P-903089058 | 98 | As a main component | 500 g |
| P-905487126 | 98 | As a main component | 1000 g |
| P-596976673 | 98 | As a main component | 2.5 kg |
| P-864126587 | 97 | As a main component | in stock |
| P-893236698 | 95 | As a main component | in stock |
| P-617651746 | 90 | As a main component | in stock |
| P-584604377 | 95 | As a main component | 280 g |
| P-851250618 | 95 | As a main component | by synthesis |
| P-580451033 | 99 | As a main component | in stock |
| P-868577702 | 96 | As a main component | in stock |
| P-579476737 | 95 | As a main component | in stock |
| P-870654012 | N/A | As a main component | in stock |
| P-488543867 | 90 | As a main component | in stock |
| P-596548728 | 97 | As a main component | 100 mg |
| P-579660125 | 95 | As a main component | by resynthesis (? - ? days) |
| P-852523607 | N/A | As a main component | in stock |
| P-901577672 | 95 | As a main component | in stock |
| P-854692610 | 95 | As a main component | in stock |
| P-584623218 | 95 | As a main component | in stock |
| P-608276941 | 98 | As a main component | in stock |
| P-454363790 | 92 | As a main component | in stock |
| P-13677861 | 92 | As a main component | 132 mg |
| P-1263958619 | 90 | As a main component | in stock |
| P-885547809 | 95 | As a main component | by synthesis |
| P-675099017 | 90 | As a main component | in stock |
| P-579711505 | N/A | As a main component | in stock |
| P-892213638 | 95 | As a main component | by synthesis |
| P-869175371 | 95 | As a main component | in stock |
| P-892286486 | 95 | As a main component | unavailable |
| P-892310019 | 95 | As a main component | 202 mg |
| P-906778973 | 98 | As a main component | by synthesis |
| P-611365971 | 90 | As a main component | in stock |
| P-617769087 | 90 | As a main component | 433 mg |
| P-615391581 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 153.178 |
| logP | 1.0846 |
| H-bond acceptors | 3 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 66.48 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 42.1072 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
