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Compound Detail

CHEMBL1928873

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CC1(c2ccccc2)Sc2nncn2N=C1c1ccc2c(c1)NC(=O)CO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1928873
Phase Preclinical
Structure Type MOL
InChI Key KPJQPEQKKOQWEV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
2.88
ALogP
7
HBA
1
HBD
81.4
PSA (Ų)
0.74
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 C19H15N5O2S
MW 377.43
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.87

Literature References

PubMed DOI Target Context # Activities
22074142 10.1021/jm2011645 Mineralocorticoid receptor 1
22074142 10.1021/jm2011645 Glucocorticoid receptor 1
22074142 10.1021/jm2011645 Androgen receptor 1
22074142 10.1021/jm2011645 Progesterone receptor 1

Data from ChEMBL 36 via Core Engine