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Compound Detail

CHEMBL1624511

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Cc1ccc(-[n+]2c(-c3ccc(Br)cc3)cn3c2CCc2ccc4cccnc4c2-3)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1624511
Phase Preclinical
Structure Type MOL
InChI Key XZGBHFABTFSDLU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

467.4
MW (Da)
6.14
ALogP
2
HBA
0
HBD
21.7
PSA (Ų)
0.29
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H21BrN3+
MW 467.39
Aromatic Rings 5
Heavy Atoms 31
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine