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Compound Detail

CHEMBL535663

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CNC(=N)c1ccc(N2CCN(c3ccc(C(=N)NC)cc3)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL535663
Phase Preclinical
Structure Type MOL
InChI Key OGRCWLUJCGXAOS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.5
MW (Da)
2.10
ALogP
4
HBA
4
HBD
78.2
PSA (Ų)
0.50
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H26N6
MW 350.47
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine