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Compound Detail

CHEMBL1195343

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C=C(Br)C(=O)Nc1ccc2oc(C(=O)Nc3cc(C(=O)Nc4cc(C(=O)Nc5cc(C(=O)NCCC(=N)N)n(C)c5)n(C)c4)n(C)c3)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195343
Phase Preclinical
Structure Type MOL
InChI Key CAZHDRTWFZEQGG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

745.6
MW (Da)
4.11
ALogP
10
HBA
7
HBD
223.3
PSA (Ų)
0.06
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H33BrN10O6
MW 745.59
Aromatic Rings 5
Heavy Atoms 50
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine