Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8902638361-0
Structure
Show compound
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 | 34 USD | 90 | 23 working days | Get Quote |
| 5 mg | 36 USD | 95 | 26 working days | Get Quote |
| 10 mg | 41 USD | 95 | 26 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.
| Name | File |
|---|---|
| SDF | MCULE-8902638361-0.sdf |
| SMILES | MCULE-8902638361-0.smiles |
| Standard InChI | MCULE-8902638361-0.inchi |
| InChIKey | MCULE-8902638361-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-890137342 | N/A | As is | in stock |
| P-590405887 | 95 | As is | in stock |
| P-903010100 | 98 | As is | 15 g |
| P-893459027 | 90 | As is | 209.456 g |
| P-606859482 | N/A | As is | in stock |
| P-489234764 | 97 | As is | in stock |
| P-881088816 | 98 | As is | 10 g |
| P-870025346 | 90 | As is | 1000 mg |
| P-889780587 | 95 | As is | in stock |
| P-427942375 | 90 | As is | 5 mg |
| P-577167937 | 90 | As is | by synthesis |
| P-517290320 | 95 | As is | 16 g |
| P-517093237 | 90 | As is | in stock |
| P-868646751 | 98 | As is | in stock |
| P-579719550 | N/A | As is | by resynthesis (? - ? days) |
| P-569207719 | 90 | As is | in stock |
| P-569436108 | 95 | As is | 5.67 g |
| P-896537651 | 95 | As is | 7.75 g |
| P-890218673 | 90 | As is | in stock |
| P-590341102 | 90 | As is | 1000 mg |
| P-502453332 | 95 | As is | by synthesis |
| P-502724701 | 90 | As is | in stock |
| P-502822871 | 90 | As is | in stock |
| P-492214441 | 95 | As is | in stock |
| P-855980983 | 95 | As is | 10 g |
| P-467963773 | 95 | As is | 212 mg |
| P-460530610 | 90 | As is | 889 mg |
| P-25738997 | 90 | As is | 212 mg |
| P-852382403 | N/A | As is | in stock |
| P-895263431 | 95 | As is | by synthesis |
| P-856064780 | 95 | As is | in stock |
| P-19151793 | 90 | As is | in stock |
| P-502350547 | 90 | As is | in stock |
| P-888431773 | 94 | As is | by resynthesis (? - ? days) |
| P-906832330 | 98 | As is | by synthesis |
| P-611397393 | 90 | As is | in stock |
| P-2325583 | 90 | As is | 100 mg |
| P-894000335 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 269.319 |
| logP | 2.5781 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 83.06 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 70.4203 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
