MCULE-3246238175
- 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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 USD | 98 | 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-3246238175.sdf |
| SMILES | MCULE-3246238175.smiles |
| Standard InChI | MCULE-3246238175.inchi |
| InChIKey | MCULE-3246238175.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875706865 | N/A | As is | in stock |
| P-590398039 | 98 | As is | in stock |
| P-903032353 | 98 | As is | 300 g |
| P-580267425 | 95 | As is | by synthesis |
| P-606862246 | N/A | As is | in stock |
| P-596940873 | 98 | As is | 300 g |
| P-494320674 | 95 | As is | 31.6 g |
| P-864098166 | 95 | As is | in stock |
| P-590635566 | 98 | As is | 1000 mg |
| P-851271525 | 95 | As is | by synthesis |
| P-861281002 | 97 | As is | in stock |
| P-868593648 | 98 | As is | in stock |
| P-580432424 | 95 | As is | by resynthesis (? - ? days) |
| P-889110220 | 98 | As is | 1000 mg |
| P-505540501 | 95 | As is | in stock |
| P-454317070 | 90 | As is | 423 mg |
| P-608086467 | 95 | As is | 500 g |
| P-856012993 | 90 | As is | unavailable |
| P-580469279 | 95 | As is | by synthesis |
| P-852376951 | N/A | As is | in stock |
| P-895256320 | 95 | As is | by synthesis |
| P-889884528 | 95 | As is | by synthesis |
| P-904092394 | 95 | As is | 262 g |
| P-502392675 | 90 | As is | in stock |
| P-22531743 | 90 | As is | 980 mg |
| P-906761101 | 98 | As is | by synthesis |
| P-611370353 | 90 | As is | in stock |
| P-480869681 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 160.571 |
| logP | 1.9714 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 37.5378 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |

