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Compound Detail

CHEMBL1617076

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CCC(C)Cn1c(O)cc2nn(-c3nc4ccccc4s3)c(=O)c-2c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1617076
Phase Preclinical
Structure Type MOL
InChI Key GAEWOOZKUROAPV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.5
MW (Da)
3.81
ALogP
7
HBA
1
HBD
72.9
PSA (Ų)
0.59
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 C19H20N4O2S
MW 368.46
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -1.51

Data from ChEMBL 36 via Core Engine