MCULE-2920977675-0
- 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 | 15 USD | 98 | 22 working days | Get Quote |
| 5 mg | 36 USD | 98 | 22 working days | Get Quote |
| 10 mg | 56 USD | 98 | 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.
-
MCULE-1626969379-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2920977675-0.sdf |
| SMILES | MCULE-2920977675-0.smiles |
| Standard InChI | MCULE-2920977675-0.inchi |
| InChIKey | MCULE-2920977675-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892858958 | N/A | As is | in stock |
| P-890151044 | N/A | As is | in stock |
| P-902995811 | 95 | As is | by resynthesis (? - ? days) |
| P-1270316814 | 99 | As is | in stock |
| P-901662503 | N/A | As is | in stock |
| P-895096409 | 99 | As is | 250 mg |
| P-1268701807 | 98 | As is | in stock |
| P-901545280 | 95 | As is | by synthesis |
| P-860798464 | 98 | As is | in stock |
| P-868078735 | 95 | As is | in stock |
| P-869152436 | 95 | As is | 96 mg |
| P-888651269 | 95 | As is | 96 mg |
| P-1271708266 | 99 | As is | in stock |
| P-867612506 | 98 | As a main component | in stock |
| P-867681648 | 98 | As a main component | in stock |
| P-875772959 | 98 | As a main component | in stock |
| P-875859208 | 98 | As a main component | in stock |
| P-874645071 | N/A | As a main component | by resynthesis (? - ? days) |
| P-1270387171 | 98 | As a main component | in stock |
| P-606863111 | N/A | As a main component | in stock |
| P-891664564 | N/A | As a main component | by synthesis |
| P-596963042 | 98 | As a main component | 250 mg |
| P-896023561 | 95 | As a main component | in stock |
| P-868544754 | 99 | As a main component | in stock |
| P-893267643 | 95 | As a main component | by synthesis |
| P-860798663 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 289.715 |
| logP | 3.076 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 70.92 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 81.1354 |
| Atoms | 32 |
| Rings | 4 |
| Heavy atoms | 20 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |

