Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5163280216-0
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 | 26 USD | 98 | 11 working days | Get Quote |
| 5 mg | 26 USD | 98 | 11 working days | Get Quote |
| 10 mg | 26 USD | 98 | 11 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-4600634401-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-5163280216-0.sdf |
| SMILES | MCULE-5163280216-0.smiles |
| Standard InChI | MCULE-5163280216-0.inchi |
| InChIKey | MCULE-5163280216-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867633811 | 98 | As is | in stock |
| P-875798172 | N/A | As is | in stock |
| P-590389581 | 98 | As is | in stock |
| P-903152782 | 99 | As is | 300 mg |
| P-893524125 | 90 | As is | 2.502 g |
| P-580234708 | 95 | As is | by synthesis |
| P-606947645 | N/A | As is | in stock |
| P-25940732 | 70 | As is | 100 mg |
| P-596967038 | N/A | As is | 1.25 g |
| P-864154501 | 95 | As is | in stock |
| P-500413990 | 95 | As is | by synthesis |
| P-580720990 | 98 | As is | 1.303 g |
| P-900268062 | N/A | As is | by resynthesis (? - ? days) |
| P-893232012 | 95 | As is | in stock |
| P-504788485 | 90 | As is | 1 mg |
| P-448676642 | 90 | As is | 295 mg |
| P-22425265 | 90 | As is | 295 mg |
| P-452651514 | 98 | As is | in stock |
| P-425203609 | 90 | As is | in stock |
| P-608496912 | 95 | As is | in stock |
| P-675218442 | 95 | As is | in stock |
| P-855926550 | 97 | As is | 250 mg |
| P-870137806 | 95 | As is | 10 g |
| P-896628960 | 95 | As is | by synthesis |
| P-854691310 | 95 | As is | in stock |
| P-878641542 | 98 | As is | in stock |
| P-500412429 | 98 | As is | by synthesis |
| P-885533490 | 95 | As is | by synthesis |
| P-19533196 | 90 | As is | in stock |
| P-617404804 | N/A | As is | in stock |
| P-516409089 | 80 | As is | 59 mg |
| P-892252594 | 95 | As is | by synthesis |
| P-869177131 | 95 | As is | in stock |
| P-892295158 | 95 | As is | unavailable |
| P-892337557 | 95 | As is | 50 mg |
| P-22822500 | 94 | As is | by resynthesis (? - ? days) |
| P-611483800 | 90 | As is | in stock |
| P-1256997 | 90 | As is | 72 mg |
| P-868494109 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.215 |
| logP | 2.5564 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 61.81 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 65.24 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 10 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
