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Compound Detail

CHEMBL142300

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Cc1nc(Sc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)c2cc[nH]c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL142300
Phase Preclinical
Structure Type MOL
InChI Key RWWSATIOUARTAR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

385.5
MW (Da)
4.26
ALogP
6
HBA
2
HBD
96.0
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H15N7S
MW 385.46
Aromatic Rings 5
Heavy Atoms 28
NP-Likeness -1.17

Literature References

PubMed DOI Target Context # Activities
7473594 10.1021/jm00023a006 Angiotensin II receptor 1

Data from ChEMBL 36 via Core Engine