Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4095349886
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 27 USD | 98 | 22 working days | Get Quote |
| 5 mg | 27 USD | 98 | 22 working days | Get Quote |
| 10 mg | 36 USD | 95 | 7 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-7994163547
- Component type: Main
-
MCULE-5511007277
- Component type: Main
-
MCULE-4858071066
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4095349886.sdf |
| SMILES | MCULE-4095349886.smiles |
| Standard InChI | MCULE-4095349886.inchi |
| InChIKey | MCULE-4095349886.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867536148 | N/A | As is | in stock |
| P-867606874 | N/A | As is | in stock |
| P-867608963 | N/A | As is | in stock |
| P-1275198053 | 95 | As is | in stock |
| P-874601755 | N/A | As is | by resynthesis (? - ? days) |
| P-869213687 | 95 | As is | by resynthesis (? - ? days) |
| P-872726400 | 98 | As is | in stock |
| P-1264057669 | 99 | As is | in stock |
| P-893575237 | 90 | As is | 4.859 g |
| P-893584712 | 90 | As is | 5.813 g |
| P-1270319926 | 97 | As is | in stock |
| P-851939749 | N/A | As is | in stock |
| P-851450992 | N/A | As is | by synthesis |
| P-851881002 | N/A | As is | by synthesis |
| P-489229561 | 97 | As is | in stock |
| P-895092994 | N/A | As is | 100 mg |
| P-619154530 | 97 | As is | 1000 mg |
| P-619187366 | 97 | As is | 250 mg |
| P-1273259380 | 95 | As is | by resynthesis (? - ? days) |
| P-1273261276 | 95 | As is | by resynthesis (? - ? days) |
| P-1273266314 | 95 | As is | by resynthesis (? - ? days) |
| P-889572854 | 95 | As is | in stock |
| P-868544676 | 99 | As is | in stock |
| P-868544702 | 99 | As is | in stock |
| P-901425563 | 95 | As is | by synthesis |
| P-901457262 | 95 | As is | by synthesis |
| P-860800226 | 98 | As is | in stock |
| P-855952534 | 95 | As is | 1 mg |
| P-1273110080 | 95 | As is | 100 mg |
| P-608270023 | 98 | As is | in stock |
| P-888895502 | N/A | As is | in stock |
| P-889883841 | 95 | As is | by synthesis |
| P-892294912 | 95 | As is | unavailable |
| P-892291559 | 95 | As is | unavailable |
| P-892287487 | 95 | As is | unavailable |
| P-869110077 | 95 | As is | 98 mg |
| P-555326554 | 95 | As is | 80 mg |
| P-869127887 | 95 | As is | 498 mg |
| P-888656132 | 95 | As is | 80 mg |
| P-888628487 | 95 | As is | 98 mg |
| P-888640805 | 95 | As is | 492 mg |
| P-906840138 | 97 | As is | by synthesis |
| P-611422879 | 90 | As is | in stock |
| P-854967259 | 90 | As is | in stock |
| P-1271722511 | 97 | As is | in stock |
| P-1271285205 | 98 | As is | by synthesis |
| P-867612697 | 98 | As a main component | in stock |
| P-886587439 | N/A | As a main component | in stock |
| P-867612788 | N/A | As a main component | in stock |
| P-892783959 | 95 | As a main component | by resynthesis (? - ? days) |
| P-874609588 | N/A | As a main component | by resynthesis (? - ? days) |
| P-892786662 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1264053701 | 98 | As a main component | in stock |
| P-893608525 | 90 | As a main component | 3.13 g |
| P-610995063 | 90 | As a main component | 10.799 g |
| P-1270319924 | 98 | As a main component | in stock |
| P-1270348615 | 98 | As a main component | in stock |
| P-878259712 | N/A | As a main component | in stock |
| P-868816624 | N/A | As a main component | by synthesis |
| P-868817154 | N/A | As a main component | by synthesis |
| P-888816752 | 98 | As a main component | 100 mg |
| P-895096493 | N/A | As a main component | 100 mg |
| P-1271930036 | 98 | As a main component | 200 mg |
| P-1273265897 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273404520 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273405471 | 95 | As a main component | by resynthesis (? - ? days) |
| P-889498502 | 95 | As a main component | by synthesis |
| P-889587387 | 95 | As a main component | in stock |
| P-889550179 | 95 | As a main component | in stock |
| P-868545130 | 99 | As a main component | in stock |
| P-860799237 | 98 | As a main component | in stock |
| P-608495628 | 95 | As a main component | in stock |
| P-868079484 | 95 | As a main component | in stock |
| P-504617831 | 90 | As a main component | by synthesis |
| P-873246601 | 90 | As a main component | 5 mg |
| P-888622777 | 95 | As a main component | 1 mg |
| P-904059739 | 95 | As a main component | by synthesis |
| P-888169226 | 98 | As a main component | by synthesis |
| P-579712721 | 98 | As a main component | in stock |
| P-904223403 | 95 | As a main component | unavailable |
| P-869162488 | 95 | As a main component | unavailable |
| P-904249176 | 95 | As a main component | unavailable |
| P-892297939 | 95 | As a main component | unavailable |
| P-904239384 | 95 | As a main component | unavailable |
| P-888657853 | 95 | As a main component | unavailable |
| P-869157930 | 95 | As a main component | 1.021 g |
| P-892264666 | 95 | As a main component | 100 mg |
| P-888653864 | 95 | As a main component | 1.019 g |
| P-892345649 | 95 | As a main component | 100 mg |
| P-1271722596 | 98 | As a main component | in stock |
| P-868494154 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 373.486 |
| logP | 5.7504 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 41.49 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 116.8437 |
| Atoms | 55 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 27 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
