Compound Detail
CHEMBL3139992
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CCn1c(=O)/c(=C2\Sc3cccc(F)c3N2C)s/c1=C\c1scc[n+]1Cc1ccc(CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)cc1
Basic Information
| ChEMBL ID | CHEMBL3139992 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZKKROPFMLYCSD-QIFYBHRUSA-O |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
738.0
MW (Da)
3.94
ALogP
9
HBA
3
HBD
99.3
PSA (Ų)
0.12
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Data from ChEMBL 36 via Core Engine