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Compound Detail

CHEMBL1189872

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NCCCC[C@H](NC(=O)c1ccc(F)cc1F)C(=O)c1noc(Cc2ccc(OCCc3ccc(Cl)c(Cl)c3)cc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189872
Phase Preclinical
Structure Type MOL
InChI Key ACIRAJIHJQLJDI-SANMLTNESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

617.5
MW (Da)
5.98
ALogP
7
HBA
2
HBD
120.3
PSA (Ų)
0.13
QED
2
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H28Cl2F2N4O4
MW 617.48
Aromatic Rings 4
Heavy Atoms 42
NP-Likeness -1.06

Data from ChEMBL 36 via Core Engine