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Compound Detail

CHEMBL501572

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CCc1ccc(NC2=NCCN2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL501572
Phase Preclinical
Structure Type MOL
InChI Key SSZXIZSMNZHHAJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

189.3
MW (Da)
1.62
ALogP
3
HBA
2
HBD
36.4
PSA (Ų)
0.74
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 C11H15N3
MW 189.26
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine