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Compound Detail

CHEMBL4595211

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Cc1cc(F)cc2c(=O)[nH]c(-c3ccc(C4CCNCC4)cc3)nc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595211
Phase Preclinical
Structure Type MOL
InChI Key NRGTYYQXOBIJNO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

337.4
MW (Da)
3.50
ALogP
3
HBA
2
HBD
57.8
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20FN3O
MW 337.40
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.93

Data from ChEMBL 36 via Core Engine