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Compound Detail

CHEMBL4596009

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O=C(O)[C@H]1C2C=CC(CC2)[C@@H]1Nc1nc(-c2n[nH]c3ncc(F)cc23)ncc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596009
Phase Preclinical
Structure Type MOL
InChI Key VBONKCBPROCYAQ-FPFWAFECSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

398.4
MW (Da)
2.77
ALogP
6
HBA
3
HBD
116.7
PSA (Ų)
0.58
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16F2N6O2
MW 398.37
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine