MCULE-1142637611-0
- 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 | 18 USD | 97 | 20 working days | Get Quote |
| 5 mg | 18 USD | 97 | 20 working days | Get Quote |
| 10 mg | 18 USD | 97 | 20 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-1142637611-0.sdf |
| SMILES | MCULE-1142637611-0.smiles |
| Standard InChI | MCULE-1142637611-0.inchi |
| InChIKey | MCULE-1142637611-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875746611 | N/A | As is | in stock |
| P-505350695 | 98 | As is | in stock |
| P-881671462 | 95 | As is | in stock |
| P-903077837 | 97 | As is | 900 g |
| P-893513553 | 90 | As is | 844 g |
| P-606837809 | N/A | As is | in stock |
| P-489192806 | 97 | As is | in stock |
| P-597002712 | 97 | As is | 800 g |
| P-494327583 | 95 | As is | by resynthesis (? - ? days) |
| P-864110412 | 95 | As is | in stock |
| P-890239020 | 98 | As is | 6 g |
| P-901554126 | 95 | As is | by synthesis |
| P-454724691 | 90 | As is | in stock |
| P-436470282 | 95 | As is | 1000 mg |
| P-868567447 | 96 | As is | in stock |
| P-580435721 | 95 | As is | by resynthesis (? - ? days) |
| P-580439746 | 95 | As is | by resynthesis (? - ? days) |
| P-579720620 | N/A | As is | by resynthesis (? - ? days) |
| P-889111089 | 90 | As is | 172 g |
| P-579524039 | 90 | As is | 1000 mg |
| P-890212813 | 90 | As is | 1000 mg |
| P-503002854 | 90 | As is | in stock |
| P-492234036 | 95 | As is | in stock |
| P-524162511 | 98 | As is | 25 g |
| P-608084355 | 95 | As is | 25 g |
| P-615356108 | 95 | As is | by synthesis |
| P-852379551 | N/A | As is | in stock |
| P-854749422 | 95 | As is | in stock |
| P-888890693 | N/A | As is | in stock |
| P-859989467 | 95 | As is | by synthesis |
| P-596783975 | 95 | As is | 10.39 g |
| P-23340547 | 90 | As is | in stock |
| P-502371796 | 90 | As is | in stock |
| P-906820887 | 98 | As is | by synthesis |
| P-611480420 | 90 | As is | in stock |
| P-855349492 | 90 | As is | in stock |
| P-588839300 | N/A | As is | by synthesis |
| P-886891364 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.627 |
| logP | 2.0858 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 43.37 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 52.5455 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |

