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Compound Detail

CHEMBL1649764

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Cc1cc2c(cc1C(=O)O)nc(Nc1cccc(Cl)c1)c1ccncc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1649764
Phase Preclinical
Structure Type MOL
InChI Key QYCAXPZBXKEFNF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

363.8
MW (Da)
5.19
ALogP
4
HBA
2
HBD
75.1
PSA (Ų)
0.49
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H14ClN3O2
MW 363.80
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.17

Literature References

PubMed DOI Target Context # Activities
21174434 10.1021/jm101251q Casein kinase II 1

Data from ChEMBL 36 via Core Engine