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Compound Detail

CHEMBL1191669

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C=C(Br)C(=O)Nc1cc(C(=O)Nc2cc(C(=O)NCCC(=N)N)n(C)c2)n(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191669
Phase Preclinical
Structure Type MOL
InChI Key VICMNYWHKUHIII-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

464.3
MW (Da)
1.52
ALogP
6
HBA
5
HBD
147.0
PSA (Ų)
0.23
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H22BrN7O3
MW 464.32
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.64

Data from ChEMBL 36 via Core Engine