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Compound Detail

CHEMBL1182879

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Cc1nc(-c2ccc(F)cc2)c(-c2ccc3nc(N)n(S(=O)(=O)C(C)C)c3c2)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182879
Phase Preclinical
Structure Type MOL
InChI Key NFZXNYFVYMPUCW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

413.5
MW (Da)
3.71
ALogP
6
HBA
2
HBD
106.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20FN5O2S
MW 413.48
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine