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Compound Detail

CHEMBL1784722

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CC1OCCC1Sc1ccc2c3c(cccc13)C1=NC(=O)C(C#N)=C12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1784722
Phase Preclinical
Structure Type MOL
InChI Key MHPJAEWEVSPYJK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

346.4
MW (Da)
3.73
ALogP
4
HBA
0
HBD
62.5
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H14N2O2S
MW 346.41
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.30

Literature References

PubMed DOI Target Context # Activities
21517068 10.1021/jm200258t Fibroblast growth factor receptor 1 1

Data from ChEMBL 36 via Core Engine