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Compound Detail

CHEMBL89246

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CCCCc1nn(CCCC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL89246
Phase Preclinical
Structure Type MOL
InChI Key ABSPPPOSOQKHEQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

673.9
MW (Da)
8.40
ALogP
8
HBA
0
HBD
83.4
PSA (Ų)
0.11
QED
2
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C43H43N7O
MW 673.87
Aromatic Rings 7
Heavy Atoms 51
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80290-0 Type-1 angiotensin II receptor B 1

Data from ChEMBL 36 via Core Engine