Compound Detail
CHEMBL3616899
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CC#CCn1c(NCCNC(=O)c2ccncc2)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C
Basic Information
| ChEMBL ID | CHEMBL3616899 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PDABINUKHOPLSW-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
537.6
MW (Da)
1.46
ALogP
11
HBA
2
HBD
141.6
PSA (Ų)
0.22
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00167B | Prolyl endopeptidase FAP | 1 |
| - | 10.1039/C4MD00167B | Dipeptidyl peptidase 4 | 1 |
| - | 10.1039/C4MD00167B | Prolyl endopeptidase | 1 |
| - | 10.1039/C4MD00167B | Dipeptidyl peptidase 9 | 1 |
| - | 10.1039/C4MD00167B | Dipeptidyl peptidase 2 | 1 |
Data from ChEMBL 36 via Core Engine