MCULE-2022398365
- 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 | 97 | 24 working days | Get Quote |
| 5 mg | 13 USD | 97 | 24 working days | Get Quote |
| 10 mg | 13 USD | 97 | 24 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-5100293043
- Component type: Main
-
MCULE-9570072251
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2022398365.sdf |
| SMILES | MCULE-2022398365.smiles |
| Standard InChI | MCULE-2022398365.inchi |
| InChIKey | MCULE-2022398365.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867567257 | 98 | As is | in stock |
| P-867671553 | 98 | As is | in stock |
| P-875727241 | 98 | As is | in stock |
| P-1265907278 | 98 | As is | in stock |
| P-1275192945 | 98 | As is | in stock |
| P-1275154575 | 95 | As is | in stock |
| P-1264630340 | 98 | As is | 25 g |
| P-893486171 | 90 | As is | 929.13 g |
| P-1270401887 | 97 | As is | in stock |
| P-1274944351 | N/A | As is | by synthesis |
| P-851954594 | N/A | As is | in stock |
| P-596929669 | 95 | As is | unavailable |
| P-1271990987 | 98 | As is | 10 g |
| P-1273283763 | 95 | As is | by resynthesis (? - ? days) |
| P-579785212 | 95 | As is | by resynthesis (? - ? days) |
| P-864142486 | 95 | As is | in stock |
| P-860056538 | 98 | As is | by synthesis |
| P-901870605 | 97 | As is | by synthesis |
| P-905500167 | N/A | As is | in stock |
| P-901462718 | 95 | As is | by synthesis |
| P-851273823 | 95 | As is | by synthesis |
| P-868645881 | 97 | As is | in stock |
| P-905351261 | 95 | As is | 3 g |
| P-862091215 | 95 | As is | 98.13 g |
| P-870648076 | N/A | As is | in stock |
| P-505532953 | 95 | As is | in stock |
| P-524165130 | 98 | As is | 1000 mg |
| P-524168068 | 98 | As is | 1000 mg |
| P-524165081 | 98 | As is | 1000 mg |
| P-608114014 | 95 | As is | in stock |
| P-613296061 | 95 | As is | by synthesis |
| P-580513484 | 97 | As is | in stock |
| P-1272602733 | 97 | As is | 100 g |
| P-852603162 | 97 | As is | by synthesis |
| P-878643530 | 98 | As is | in stock |
| P-885551023 | 95 | As is | by synthesis |
| P-906752052 | N/A | As is | by synthesis |
| P-906752053 | N/A | As is | by synthesis |
| P-906752054 | N/A | As is | by synthesis |
| P-906899065 | 30 | As is | in stock |
| P-906776585 | 98 | As is | by synthesis |
| P-611358899 | 90 | As is | in stock |
| P-1271670144 | 97 | As is | in stock |
| P-1270269065 | 98 | As a main component | in stock |
| P-867550972 | 97 | As a main component | in stock |
| P-875708860 | 97 | As a main component | in stock |
| P-1268851630 | 98 | As a main component | in stock |
| P-869267260 | 95 | As a main component | by resynthesis (? - ? days) |
| P-903034849 | 97 | As a main component | 10 g |
| P-492323471 | 95 | As a main component | in stock |
| P-1270312911 | 97 | As a main component | in stock |
| P-606889101 | N/A | As a main component | in stock |
| P-489233241 | 97 | As a main component | in stock |
| P-596941570 | 97 | As a main component | 10 g |
| P-1273453582 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864170209 | 97 | As a main component | in stock |
| P-1275585344 | 95 | As a main component | by synthesis |
| P-580723029 | 97 | As a main component | 6.35 g |
| P-868626425 | 97 | As a main component | in stock |
| P-861970588 | 97 | As a main component | 10 g |
| P-454403590 | 95 | As a main component | 500 mg |
| P-524200715 | 95 | As a main component | 5 g |
| P-524181053 | 97 | As a main component | 1000 mg |
| P-1264392804 | 95 | As a main component | in stock |
| P-895202681 | 95 | As a main component | by synthesis |
| P-885551022 | 95 | As a main component | by synthesis |
| P-892294086 | 95 | As a main component | unavailable |
| P-869159564 | 95 | As a main component | 100 mg |
| P-888655091 | 95 | As a main component | 100 mg |
| P-611358900 | 90 | As a main component | in stock |
| P-615403089 | 97 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 113.114 |
| logP | 0.1219 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 28.7902 |
| Atoms | 15 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |

