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Compound Detail

CHEMBL1191384

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COc1cccc(NC(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191384
Phase Preclinical
Structure Type MOL
InChI Key MMOFEVOHPIADGM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

621.3
MW (Da)
6.08
ALogP
6
HBA
2
HBD
97.2
PSA (Ų)
0.25
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H24BrCl2N5O4
MW 621.32
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -1.80

Data from ChEMBL 36 via Core Engine