MCULE-2649903903
- 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 | 13 USD | 95 | 11 working days | Get Quote |
| 5 mg | 13 USD | 95 | 11 working days | Get Quote |
| 10 mg | 13 USD | 95 | 11 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.
-
1
MCULE-1254555434
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2649903903.sdf |
| SMILES | MCULE-2649903903.smiles |
| Standard InChI | MCULE-2649903903.inchi |
| InChIKey | MCULE-2649903903.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867662709 | 98 | As is | in stock |
| P-875831808 | N/A | As is | in stock |
| P-505348306 | 98 | As is | in stock |
| P-903207973 | 97 | As is | 25 g |
| P-851152401 | 97 | As is | 50 g |
| P-580194216 | 98 | As is | in stock |
| P-904971821 | 95 | As is | by synthesis |
| P-901462515 | 95 | As is | by synthesis |
| P-505576183 | 98 | As is | in stock |
| P-617651761 | 90 | As is | in stock |
| P-584604456 | 95 | As is | 6 g |
| P-851268329 | 95 | As is | by synthesis |
| P-868594096 | 95 | As is | in stock |
| P-608497960 | 95 | As is | in stock |
| P-505521096 | 95 | As is | in stock |
| P-488555526 | 92 | As is | in stock |
| P-488549097 | 90 | As is | in stock |
| P-596548651 | 98 | As is | 100 mg |
| P-31194883 | 90 | As is | 500 mg |
| P-852534248 | N/A | As is | in stock |
| P-896630143 | 95 | As is | by synthesis |
| P-854719449 | 95 | As is | in stock |
| P-871073652 | 95 | As is | in stock |
| P-878640419 | 98 | As is | in stock |
| P-454367895 | 92 | As is | in stock |
| P-13317195 | 92 | As is | 130 mg |
| P-500375995 | 98 | As is | by synthesis |
| P-885546400 | 95 | As is | by synthesis |
| P-889852902 | 95 | As is | by synthesis |
| P-675115011 | 90 | As is | in stock |
| P-579711043 | N/A | As is | in stock |
| P-589631395 | N/A | As is | in stock |
| P-869118158 | 95 | As is | by synthesis |
| P-892288751 | 95 | As is | unavailable |
| P-888633253 | 95 | As is | 51 mg |
| P-873225556 | 90 | As is | in stock |
| P-906779565 | 97 | As is | by synthesis |
| P-611379587 | 90 | As is | in stock |
| P-617715551 | 90 | As is | 1.011 g |
| P-617773815 | 90 | As is | 1.011 g |
| P-575330956 | 95 | As is | in stock |
| P-875690250 | N/A | Main component | in stock |
| P-615724584 | 95 | Main component | in stock |
| P-903009710 | 95 | Main component | 20 g |
| P-905485723 | 95 | Main component | 10 g |
| P-893536789 | 90 | Main component | 48.161 g |
| P-619166391 | 95 | Main component | 15 g |
| P-864180281 | 95 | Main component | in stock |
| P-868626764 | 95 | Main component | in stock |
| P-905431873 | 95 | Main component | 4.359 g |
| P-579454035 | 95 | Main component | 5 g |
| P-1263153994 | 95 | Main component | by synthesis |
| P-901016682 | 95 | Main component | in stock |
| P-888890077 | N/A | Main component | in stock |
| P-869125160 | 95 | Main component | by synthesis |
| P-904246972 | 95 | Main component | unavailable |
| P-888638804 | 95 | Main component | 50 mg |
| P-611379586 | 90 | Main component | in stock |
| P-480941534 | 95 | Main component | in stock |
| P-489237819 | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 241.719 |
| logP | 2.7201 |
| H-bond acceptors | 5 |
| H-bond donors | 5 |
| Rotatable bonds | 6 |
| PSA | 97.78 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 68.2862 |
| Atoms | 32 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 2 |

