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Compound Detail

CHEMBL1185722

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CCS(=O)(=O)c1ccc(-c2noc(C(C)[C@H](N)C(F)=C3CCCC3)n2)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185722
Phase Preclinical
Structure Type MOL
InChI Key HTRJNCXDNJEXTE-KLLZUTDZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

427.9
MW (Da)
4.41
ALogP
6
HBA
1
HBD
99.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23ClFN3O3S
MW 427.93
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -1.51

Data from ChEMBL 36 via Core Engine