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Compound Detail

CHEMBL5987732

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C[C@@H](NC(=O)c1cc(F)c(N2CC(CC#N)(n3cc(-c4ncnc5[nH]ccc45)cn3)C2)cc1F)C(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5987732
Phase Preclinical
Structure Type MOL
InChI Key UHEIPWYAZVECGS-CYBMUJFWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

530.5
MW (Da)
3.91
ALogP
7
HBA
2
HBD
115.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H19F5N8O
MW 530.46
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine