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Compound Detail

CHEMBL5498932

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CNC(=O)c1nnc(Nc2ccccn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498932
Phase Preclinical
Structure Type MOL
InChI Key JHYMZJKRDFVXDT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

447.4
MW (Da)
2.72
ALogP
10
HBA
3
HBD
139.7
PSA (Ų)
0.39
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H18FN9O2
MW 447.43
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -1.17

Data from ChEMBL 36 via Core Engine