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Compound Detail

CHEMBL198337

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CN1C(=O)NC(Cc2c[nH]c3c(OCc4ccccc4)cccc23)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL198337
Phase Preclinical
Structure Type MOL
InChI Key NFDNQCRYMSXBRL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

349.4
MW (Da)
2.84
ALogP
3
HBA
2
HBD
74.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N3O3
MW 349.39
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.12

Literature References

PubMed DOI Target Context # Activities
16153840 10.1016/j.bmcl.2005.07.077 Jurkat 1

Data from ChEMBL 36 via Core Engine