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Compound Detail

CHEMBL1585571

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COc1ccc(-c2cc3nc(C)cc(C)n3n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1585571
Phase Preclinical
Structure Type MOL
InChI Key CMJGBTXOHJQXLC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

253.3
MW (Da)
3.02
ALogP
4
HBA
0
HBD
39.4
PSA (Ų)
0.70
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 C15H15N3O
MW 253.31
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.96

Data from ChEMBL 36 via Core Engine