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Compound Detail

CHEMBL4786956

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O=C(c1ccc(F)c(NS(=O)(=O)Cc2ccccc2)c1F)c1n[nH]c2ncc(-c3ccncc3)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4786956
Phase Preclinical
Structure Type MOL
InChI Key SOWCTAYPMPITBR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

505.5
MW (Da)
4.47
ALogP
6
HBA
2
HBD
117.7
PSA (Ų)
0.32
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H17F2N5O3S
MW 505.51
Aromatic Rings 5
Heavy Atoms 36
NP-Likeness -1.45

Data from ChEMBL 36 via Core Engine