MCULE-4355519890
- 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 | 33 USD | 95 | 7 working days | Get Quote |
| 5 mg | 33 USD | 95 | 7 working days | Get Quote |
| 10 mg | 33 USD | 95 | 7 working days | Get Quote |
- 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-1504927010
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4355519890.sdf |
| SMILES | MCULE-4355519890.smiles |
| Standard InChI | MCULE-4355519890.inchi |
| InChIKey | MCULE-4355519890.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867650525 | 98 | As is | in stock |
| P-875817477 | 98 | As is | in stock |
| P-590366913 | 97 | As is | by resynthesis (? - ? days) |
| P-903180321 | 98 | As is | 1.75 g |
| P-893575926 | 90 | As is | 14.914 g |
| P-1270323877 | 98 | As is | in stock |
| P-851942123 | N/A | As is | in stock |
| P-489181421 | 97 | As is | in stock |
| P-597009707 | 98 | As is | 1.75 g |
| P-1273369590 | 95 | As is | by resynthesis (? - ? days) |
| P-864208955 | 95 | As is | in stock |
| P-481166949 | 95 | As is | 4.4 g |
| P-619603621 | 98 | As is | 700 mg |
| P-861396450 | 95 | As is | by synthesis |
| P-905414407 | 98 | As is | 6.764 g |
| P-1264362385 | 98 | As is | 100 mg |
| P-502484484 | 95 | As is | by synthesis |
| P-454316592 | 90 | As is | 289 mg |
| P-1272582835 | 95 | As is | 3 g |
| P-852450215 | 95 | As is | by synthesis |
| P-895181220 | 95 | As is | in stock |
| P-584613984 | 95 | As is | in stock |
| P-878646978 | 98 | As is | in stock |
| P-888881515 | N/A | As is | in stock |
| P-491099408 | 95 | As is | by synthesis |
| P-892290588 | 95 | As is | unavailable |
| P-869125051 | 95 | As is | 174 mg |
| P-888638700 | 95 | As is | 148 mg |
| P-873236274 | 90 | As is | in stock |
| P-906876765 | 98 | As is | by synthesis |
| P-611496926 | 90 | As is | in stock |
| P-611473501 | 90 | As is | in stock |
| P-886951022 | 95 | As is | by synthesis |
| P-895887317 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 149.154 |
| logP | 0.5267 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 69.62 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 40.9894 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| 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 |

