Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2919817854-0
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 | 185 USD | 97 | 27 working days | Get Quote |
| 5 mg | 185 USD | 97 | 27 working days | Get Quote |
| 10 mg | 185 USD | 97 | 27 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-5853026218-0
- Component type: Counter Ion
-
MCULE-5456512647-0
- Component type: Counter Ion
-
MCULE-8211794656-0
- Component type: Counter Ion
-
MCULE-3609678694-0
- Component type: Counter Ion
-
MCULE-1738280241-0
- Component type: Counter Ion
-
MCULE-7038326979-0
- Component type: Counter Ion
-
MCULE-4896669063-0
- Component type: Counter Ion
-
MCULE-1716676325-0
- Component type: Counter Ion
-
MCULE-5605102754-0
- Component type: Counter Ion
-
MCULE-5346150415-0
- Component type: Counter Ion
-
MCULE-1170177920-0
- Component type: Counter Ion
-
MCULE-8820019002-0
- Component type: Counter Ion
-
MCULE-8393901153-0
- Component type: Counter Ion
-
MCULE-6424978210-0
- Component type: Counter Ion
-
MCULE-3290329106-0
- Component type: Counter Ion
-
MCULE-6339500452-0
- Component type: Counter Ion
-
MCULE-1637015037-0
- Component type: Counter Ion
-
MCULE-8555271296-0
- Component type: Counter Ion
-
MCULE-3872373876-0
- Component type: Counter Ion
-
MCULE-1051823681-0
- Component type: Counter Ion
-
MCULE-8896959057-0
- Component type: Counter Ion
-
MCULE-4457952166-0
- Component type: Counter Ion
-
MCULE-3207912918-0
- Component type: Counter Ion
-
MCULE-3382456484-0
- Component type: Counter Ion
-
MCULE-3185395574-0
- Component type: Counter Ion
-
MCULE-3509744890-0
- Component type: Counter Ion
-
MCULE-9966127229-0
- Component type: Counter Ion
-
MCULE-6368554884-0
- Component type: Counter Ion
-
MCULE-2928711436-0
- Component type: Counter Ion
-
MCULE-7063918698-0
- Component type: Counter Ion
-
MCULE-6566464513-0
- Component type: Counter Ion
-
MCULE-8365848324-0
- Component type: Counter Ion
-
MCULE-8824108255-0
- Component type: Counter Ion
-
MCULE-4287507220-0
- Component type: Counter Ion
-
MCULE-4414811320-0
- Component type: Counter Ion
-
MCULE-4372008277-0
- Component type: Counter Ion
-
MCULE-3403012968-0
- Component type: Counter Ion
-
MCULE-4258837329-0
- Component type: Counter Ion
-
MCULE-8589125104-0
- Component type: Counter Ion
-
MCULE-3643782502-0
- Component type: Counter Ion
-
MCULE-4378017466-0
- Component type: Counter Ion
-
MCULE-9449345977-0
- Component type: Counter Ion
-
MCULE-2775776702-0
- Component type: Counter Ion
-
MCULE-7636837488-0
- Component type: Counter Ion
-
MCULE-7558977288-0
- Component type: Counter Ion
-
MCULE-3151939563-0
- Component type: Counter Ion
-
MCULE-8083898068-0
- Component type: Counter Ion
-
MCULE-4696867142-0
- Component type: Counter Ion
-
MCULE-3129958793-0
- Component type: Counter Ion
-
MCULE-7300002816-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2919817854-0.sdf |
| SMILES | MCULE-2919817854-0.smiles |
| Standard InChI | MCULE-2919817854-0.inchi |
| InChIKey | MCULE-2919817854-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596571624 | Key Organics | Building Blocks | 97 | As a component | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 319.227 |
| logP | 3.064 |
| H-bond acceptors | 0 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 0.0 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 110.058 |
| Atoms | 45 |
| Rings | 4 |
| Heavy atoms | 25 |
| Hydrogen atoms | 20 |
| Heteroatoms | 1 |
| N/O atoms | 0 |
| 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 |
