Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8698893976
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 | 5 USD | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 USD | 97 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-4157411281
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8698893976.sdf |
| SMILES | MCULE-8698893976.smiles |
| Standard InChI | MCULE-8698893976.inchi |
| InChIKey | MCULE-8698893976.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867563811 | 96 | As is | in stock |
| P-875722997 | N/A | As is | in stock |
| P-590391299 | 95 | As is | in stock |
| P-903052248 | 97 | As is | 300 g |
| P-905479281 | 97 | As is | 100 g |
| P-492324502 | 95 | As is | in stock |
| P-893512980 | 90 | As is | 1.33479 kg |
| P-580238810 | 95 | As is | by synthesis |
| P-606864974 | N/A | As is | in stock |
| P-596928298 | 97 | As is | 300 g |
| P-494311278 | 95 | As is | by resynthesis (? - ? days) |
| P-864088452 | 97 | As is | in stock |
| P-481168944 | 95 | As is | 4 g |
| P-580697291 | 97 | As is | 3 g |
| P-893331239 | 95 | As is | in stock |
| P-454630827 | 90 | As is | in stock |
| P-449699840 | 90 | As is | 409.795 g |
| P-1057 | 90 | As is | 73.87 g |
| P-162134 | 90 | As is | 965 mg |
| P-436452886 | 95 | As is | 100 g |
| P-578527081 | 90 | As is | in stock |
| P-851272238 | 95 | As is | by synthesis |
| P-868592330 | 97 | As is | in stock |
| P-580408663 | 95 | As is | by resynthesis (? - ? days) |
| P-861925891 | 97 | As is | 509.133 g |
| P-579484474 | 90 | As is | 1.08 g |
| P-890204804 | 90 | As is | in stock |
| P-505536125 | 95 | As is | in stock |
| P-502448801 | 95 | As is | by synthesis |
| P-675352870 | 90 | As is | in stock |
| P-675514101 | 95 | As is | in stock |
| P-488550190 | 90 | As is | in stock |
| P-13747101 | 92 | As is | 300 mg |
| P-18803102 | 95 | As is | 24.916 g |
| P-563460916 | 97 | As is | 5 g |
| P-563460917 | 97 | As is | 5 g |
| P-454381756 | 95 | As is | 100 g |
| P-615648057 | 95 | As is | in stock |
| P-31258801 | 90 | As is | unavailable |
| P-580504743 | N/A | As is | by synthesis |
| P-852381192 | N/A | As is | in stock |
| P-854740436 | 95 | As is | in stock |
| P-34053702 | 90 | As is | 5 g |
| P-492286108 | 95 | As is | 5 g |
| P-454368574 | 92 | As is | in stock |
| P-13972565 | 92 | As is | 300 mg |
| P-500381688 | 97 | As is | by synthesis |
| P-885520183 | 95 | As is | by synthesis |
| P-23890475 | 90 | As is | in stock |
| P-33484161 | 90 | As is | in stock |
| P-502329138 | 90 | As is | in stock |
| P-22554339 | 90 | As is | 2 mg |
| P-903956232 | 94 | As is | by resynthesis (? - ? days) |
| P-906770690 | 97 | As is | by synthesis |
| P-906793993 | 97 | As is | by synthesis |
| P-611365628 | 90 | As is | in stock |
| P-987486 | 90 | As is | 2.62 g |
| P-3220627 | 90 | As is | 2.62 g |
| P-893964655 | 95 | As is | in stock |
| P-854636771 | 95 | As is | in stock |
| P-4902775 | 90 | As a main component | 5 mg |
| P-905625379 | 95 | As a main component | 100 g |
| P-893806023 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 183.179 |
| logP | 2.0005 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.4592 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
