Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2877375791-0
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 | 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-2877375791-0.sdf |
| SMILES | MCULE-2877375791-0.smiles |
| Standard InChI | MCULE-2877375791-0.inchi |
| InChIKey | MCULE-2877375791-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867589447 | 98 | As is | in stock |
| P-875748860 | N/A | As is | in stock |
| P-535626084 | 95 | As is | in stock |
| P-505393432 | 98 | As is | in stock |
| P-903079899 | 98 | As is | 150 g |
| P-905478181 | 97 | As is | 10 g |
| P-893502975 | 90 | As is | 1.71849 kg |
| P-580240225 | 95 | As is | by synthesis |
| P-606900068 | N/A | As is | in stock |
| P-489182616 | 97 | As is | in stock |
| P-596955631 | 98 | As is | 500 g |
| P-864089469 | 97 | As is | in stock |
| P-580710858 | 98 | As is | 148.35 g |
| P-893235449 | 95 | As is | in stock |
| P-505576609 | 97 | As is | in stock |
| P-851286553 | 95 | As is | by synthesis |
| P-851270448 | 95 | As is | by synthesis |
| P-861273357 | 95 | As is | in stock |
| P-868578210 | 97 | As is | in stock |
| P-580299956 | 95 | As is | by resynthesis (? - ? days) |
| P-580289741 | N/A | As is | by resynthesis (? - ? days) |
| P-905336657 | 95 | As is | 52 g |
| P-861984222 | 95 | As is | 52 g |
| P-505495347 | 95 | As is | in stock |
| P-18813160 | 97 | As is | 1.618 g |
| P-454385980 | 97 | As is | 1.618 g |
| P-579613582 | 98 | As is | 50 g |
| P-878162721 | 97 | As is | by synthesis |
| P-852441556 | N/A | As is | in stock |
| P-854732397 | 95 | As is | in stock |
| P-888861381 | N/A | As is | in stock |
| P-500406464 | 98 | As is | by synthesis |
| P-885544777 | 95 | As is | by synthesis |
| P-502329699 | 90 | As is | in stock |
| P-906905957 | 97 | As is | in stock |
| P-611388527 | 90 | As is | in stock |
| P-893942527 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 111.099 |
| logP | 0.7129 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 53.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 27.752 |
| Atoms | 13 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
