Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2684217065
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 | 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 |
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-2684217065.sdf |
| SMILES | MCULE-2684217065.smiles |
| Standard InChI | MCULE-2684217065.inchi |
| InChIKey | MCULE-2684217065.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867567157 | 98 | As is | in stock |
| P-875726563 | N/A | As is | in stock |
| P-597025360 | 98 | As is | in stock |
| P-869195011 | 95 | As is | in stock |
| P-505389998 | 99 | As is | in stock |
| P-903055572 | 98 | As is | 1.5 kg |
| P-580237324 | 95 | As is | by synthesis |
| P-606891144 | N/A | As is | in stock |
| P-596947612 | 98 | As is | 1.5 kg |
| P-494309417 | 95 | As is | by resynthesis (? - ? days) |
| P-864140636 | 98 | As is | in stock |
| P-580719903 | 98 | As is | 1.255 kg |
| P-893262047 | 95 | As is | by synthesis |
| P-4283885 | 90 | As is | 25 mg |
| P-619928040 | 90 | As is | by synthesis |
| P-872693940 | 95 | As is | 25 g |
| P-19847081 | 90 | As is | in stock |
| P-868577528 | 98 | As is | in stock |
| P-580418332 | 95 | As is | by resynthesis (? - ? days) |
| P-905328983 | 99 | As is | 110 g |
| P-861925109 | 99 | As is | 2.98947 kg |
| P-505508334 | 95 | As is | in stock |
| P-12552955 | 95 | As is | 247 mg |
| P-856005894 | 99 | As is | 100 mg |
| P-524164735 | 99 | As is | 100 g |
| P-608082066 | 99 | As is | 500 g |
| P-31138883 | 90 | As is | unavailable |
| P-856045194 | 90 | As is | unavailable |
| P-580509574 | 97 | As is | by synthesis |
| P-852379011 | N/A | As is | in stock |
| P-35247217 | 90 | As is | 7.031 kg |
| P-854747287 | 95 | As is | in stock |
| P-674668016 | 92 | As is | 247 mg |
| P-500403618 | 98 | As is | by synthesis |
| P-1263958357 | 90 | As is | in stock |
| P-885545563 | 95 | As is | by synthesis |
| P-19473062 | 90 | As is | in stock |
| P-596792481 | 95 | As is | 780 g |
| P-502328534 | 90 | As is | in stock |
| P-875236833 | 90 | As is | 100 mg |
| P-854992807 | 90 | As is | in stock |
| P-997340 | 90 | As is | 334 mg |
| P-667019863 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 267.271 |
| logP | 5.0516 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 37.33 |
| RO5 violations | 1 |
| RO3 violations | 1 |
| Refractivity | 68.0457 |
| Atoms | 26 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
