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Compound Detail

CHEMBL5499018

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CNC(=O)c1nnc(Nc2ccc(F)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499018
Phase Preclinical
Structure Type MOL
InChI Key LJEGPTWBDNCYNI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

450.4
MW (Da)
2.06
ALogP
11
HBA
3
HBD
144.7
PSA (Ų)
0.38
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19FN10O2
MW 450.44
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -1.33

Data from ChEMBL 36 via Core Engine