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Compound Detail

CHEMBL1185481

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CCc1noc(C2CN=CNC2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185481
Phase Preclinical
Structure Type MOL
InChI Key IPKFWLRXFSUTDZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

180.2
MW (Da)
0.35
ALogP
5
HBA
1
HBD
63.3
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H12N4O
MW 180.21
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -1.50

Data from ChEMBL 36 via Core Engine