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Compound Detail

CHEMBL1180234

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COc1cc(CNC(=N)N)cc(CNC(=N)N)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1180234
Phase Preclinical
Structure Type MOL
InChI Key ZTPXTGRLWOIDNG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

250.3
MW (Da)
-0.34
ALogP
3
HBA
6
HBD
133.0
PSA (Ų)
0.31
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H18N6O
MW 250.31
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine