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Compound Detail

CHEMBL1208518

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O=C(O)c1ccccc1SCCn1cnc2c1NC=NCC2O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208518
Phase Preclinical
Structure Type MOL
InChI Key FWRANEOZSDJVGT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
1.86
ALogP
7
HBA
3
HBD
99.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H16N4O3S
MW 332.39
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.78

Data from ChEMBL 36 via Core Engine