MCULE-7829476338-0
- 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 | 10 USD | 98 | 20 working days | Get Quote |
| 5 mg | 26 USD | 95 | 14 working days | Get Quote |
| 10 mg | 28 USD | 98 | 16 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-7829476338-0.sdf |
| SMILES | MCULE-7829476338-0.smiles |
| Standard InChI | MCULE-7829476338-0.inchi |
| InChIKey | MCULE-7829476338-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867608856 | 98 | As is | in stock |
| P-875767784 | 98 | As is | in stock |
| P-1275178903 | 98 | As is | in stock |
| P-1275180659 | 98 | As is | in stock |
| P-1275155962 | 95 | As is | in stock |
| P-610957235 | 90 | As is | 9.934 g |
| P-606935260 | N/A | As is | in stock |
| P-489155824 | 97 | As is | in stock |
| P-596961824 | 98 | As is | 10 mg |
| P-1273452676 | 95 | As is | by resynthesis (? - ? days) |
| P-1273459988 | 95 | As is | by resynthesis (? - ? days) |
| P-864120098 | 95 | As is | in stock |
| P-900155036 | 95 | As is | in stock |
| P-868543924 | 99 | As is | in stock |
| P-893219443 | 95 | As is | in stock |
| P-893237035 | 95 | As is | in stock |
| P-851273928 | 95 | As is | by synthesis |
| P-860797897 | 98 | As is | in stock |
| P-868610388 | 98 | As is | in stock |
| P-14003214 | 92 | As is | 300 mg |
| P-596548685 | 97 | As is | 100 mg |
| P-579616999 | 95 | As is | in stock |
| P-580476473 | N/A | As is | by synthesis |
| P-1272593190 | 97 | As is | 100 mg |
| P-852492172 | 97 | As is | by synthesis |
| P-854712876 | 95 | As is | in stock |
| P-1263158983 | 95 | As is | in stock |
| P-474026684 | 95 | As is | in stock |
| P-608270039 | 98 | As is | in stock |
| P-13857921 | 92 | As is | 300 mg |
| P-500411417 | 98 | As is | by synthesis |
| P-885540370 | 95 | As is | by synthesis |
| P-868144625 | 90 | As is | in stock |
| P-617401677 | 98 | As is | in stock |
| P-892286278 | 95 | As is | unavailable |
| P-869107673 | 95 | As is | 51 mg |
| P-888626709 | 95 | As is | 51 mg |
| P-611427076 | 90 | As is | in stock |
| P-578077029 | 90 | As is | 117 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 354.438 |
| logP | 4.61 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 71.44 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 102.6228 |
| Atoms | 52 |
| Rings | 2 |
| Heavy atoms | 26 |
| Hydrogen atoms | 26 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

