MCULE-7284912081
- 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 | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 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-7284912081.sdf |
| SMILES | MCULE-7284912081.smiles |
| Standard InChI | MCULE-7284912081.inchi |
| InChIKey | MCULE-7284912081.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579552 | 97 | As is | in stock |
| P-875738854 | N/A | As is | in stock |
| P-597014538 | 95 | As is | in stock |
| P-903068959 | 99 | As is | 100 g |
| P-905484191 | 97 | As is | 100 g |
| P-610953346 | 90 | As is | 3.052 kg |
| P-901163936 | 97 | As is | in stock |
| P-893301852 | N/A | As is | in stock |
| P-606937924 | N/A | As is | in stock |
| P-489195323 | 97 | As is | in stock |
| P-596952084 | 97 | As is | 900 g |
| P-494346673 | 95 | As is | 1.35 g |
| P-864086148 | 97 | As is | in stock |
| P-481172149 | 95 | As is | 15 g |
| P-580717197 | 97 | As is | 96.45 g |
| P-505587916 | 95 | As is | in stock |
| P-851254961 | 95 | As is | by synthesis |
| P-868571678 | 96 | As is | in stock |
| P-580429348 | 95 | As is | by resynthesis (? - ? days) |
| P-489246992 | 95 | As is | in stock |
| P-861969680 | 97 | As is | 132.474 g |
| P-905333892 | 97 | As is | 21 g |
| P-14042502 | 90 | As is | no data |
| P-500159263 | 96 | As is | in stock |
| P-18789436 | 95 | As is | 68.958 g |
| P-454376737 | 95 | As is | 100 g |
| P-894994395 | 85 | As is | in stock |
| P-579635003 | 95 | As is | by resynthesis (? - ? days) |
| P-580511083 | 95 | As is | 10 g |
| P-852393555 | N/A | As is | in stock |
| P-519752355 | 97 | As is | 36.4 g |
| P-428012403 | 97 | As is | 36.4 kg |
| P-854728993 | 95 | As is | in stock |
| P-878263086 | 98 | As is | in stock |
| P-888847036 | N/A | As is | by synthesis |
| P-889876724 | 95 | As is | by synthesis |
| P-873284321 | N/A | As is | in stock |
| P-498666135 | 95 | As is | 141 g |
| P-502362715 | 90 | As is | in stock |
| P-903669311 | 94 | As is | by resynthesis (? - ? days) |
| P-611387029 | 90 | As is | in stock |
| P-666972994 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 197.032 |
| logP | 2.0968 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 17.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 42.892 |
| Atoms | 15 |
| Rings | 2 |
| Heavy atoms | 10 |
| Hydrogen atoms | 5 |
| 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 |

