MCULE-5108123240
- 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 | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 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-3135352673
- Component type: Unknown
-
MCULE-3794564775
- Component type: Main
-
MCULE-5122302808
- Component type: Main
-
MCULE-2220361257
- Component type: Main
-
MCULE-7161788007
- Component type: Main
-
MCULE-7380729766
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5108123240.sdf |
| SMILES | MCULE-5108123240.smiles |
| Standard InChI | MCULE-5108123240.inchi |
| InChIKey | MCULE-5108123240.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867587440 | 98 | As is | in stock |
| P-875746347 | 98 | As is | in stock |
| P-1275145762 | 98 | As is | in stock |
| P-1275185235 | N/A | As is | in stock |
| P-881654605 | 98 | As is | in stock |
| P-580247624 | 95 | As is | by synthesis |
| P-606874086 | N/A | As is | in stock |
| P-596931664 | 98 | As is | 6.8179 kg |
| P-864153777 | 99 | As is | in stock |
| P-893250171 | 95 | As is | by synthesis |
| P-580450167 | 99 | As is | in stock |
| P-505493187 | 95 | As is | in stock |
| P-890849860 | 95 | As is | in stock |
| P-869176969 | 95 | As is | in stock |
| P-892250393 | 95 | As is | 2.023 g |
| P-892294443 | 95 | As is | 3.998 g |
| P-892335995 | 95 | As is | 3.998 g |
| P-1271646740 | 98 | As is | in stock |
| P-860606475 | 99 | As a main component | by synthesis |
| P-889902018 | 99 | As a main component | by synthesis |
| P-904524082 | 95 | As a main component | by resynthesis (? - ? days) |
| P-615718930 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1270322004 | 98 | As a main component | in stock |
| P-580240767 | 95 | As a main component | by synthesis |
| P-606935680 | N/A | As a main component | in stock |
| P-851450767 | N/A | As a main component | by synthesis |
| P-851598521 | N/A | As a main component | by synthesis |
| P-851872771 | N/A | As a main component | by synthesis |
| P-619199035 | 99 | As a main component | 10 kg |
| P-864184223 | 95 | As a main component | in stock |
| P-893221271 | 95 | As a main component | in stock |
| P-580426759 | 95 | As a main component | by resynthesis (? - ? days) |
| P-505538142 | 95 | As a main component | in stock |
| P-618022721 | 92 | As a main component | 300 mg |
| P-35239734 | 90 | As a main component | in stock |
| P-500381057 | 98 | As a main component | by synthesis |
| P-500381093 | 98 | As a main component | by synthesis |
| P-869175423 | 95 | As a main component | in stock |
| P-892213794 | 95 | As a main component | 3.788 g |
| P-892286652 | 95 | As a main component | 2 g |
| P-892310170 | 95 | As a main component | 2 g |
| P-855314691 | 90 | As a main component | in stock |
| P-854976313 | 90 | As a main component | in stock |
| P-854976320 | 90 | As a main component | in stock |
| P-855364349 | 90 | As a main component | in stock |
| P-1271628234 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 174.201 |
| logP | 0.5528 |
| H-bond acceptors | 6 |
| H-bond donors | 5 |
| Rotatable bonds | 6 |
| PSA | 125.22 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 44.535 |
| Atoms | 26 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 14 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |

