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Compound Detail

CHEMBL4597524

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O=C(NCc1ncccc1F)c1csc(CCNCc2nc3ccccc3[nH]2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597524
Phase Preclinical
Structure Type MOL
InChI Key NWXFZWSKOGLWKB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

410.5
MW (Da)
2.82
ALogP
6
HBA
3
HBD
95.6
PSA (Ų)
0.39
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19FN6OS
MW 410.48
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -2.04

Data from ChEMBL 36 via Core Engine