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Compound Detail

CHEMBL1187696

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N#C[C@@]1(NC(=O)C(N)Cc2sccc2F)C[C@@H]1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187696
Phase Preclinical
Structure Type MOL
InChI Key UUKJIEBFYVGYRF-YTQWVHSASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
2.32
ALogP
4
HBA
2
HBD
78.9
PSA (Ų)
0.88
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16FN3OS
MW 329.40
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.54

Data from ChEMBL 36 via Core Engine