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Compound Detail

CHEMBL1178347

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COCc1noc(C2CN=CNC2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178347
Phase Preclinical
Structure Type MOL
InChI Key BXAWVPFKZADADI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

196.2
MW (Da)
-0.07
ALogP
6
HBA
1
HBD
72.5
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H12N4O2
MW 196.21
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -1.32

Data from ChEMBL 36 via Core Engine