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Compound Detail

CHEMBL4596378

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Cc1c(-c2cccc(S(=O)(=O)N(C)C)c2)c2ncccc2n1C/C(F)=C/CN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596378
Phase Preclinical
Structure Type MOL
InChI Key YNYGVGYGPMQAEL-SXGWCWSVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

402.5
MW (Da)
3.07
ALogP
5
HBA
1
HBD
81.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23FN4O2S
MW 402.50
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.35

Data from ChEMBL 36 via Core Engine