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Compound Detail

CHEMBL4597600

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COc1ccc2c(c1)c(-c1[nH]c(N)nc1C)cn2S(=O)(=O)c1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597600
Phase Preclinical
Structure Type MOL
InChI Key KNJPQUOOYYJYMY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
4.32
ALogP
6
HBA
2
HBD
103.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H20N4O3S
MW 432.51
Aromatic Rings 5
Heavy Atoms 31
NP-Likeness -0.76

Data from ChEMBL 36 via Core Engine