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Compound Detail

CHEMBL355625

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CC(C)C[C@H](NC(=O)CC(O)[C@H](CC(C)C)NC(=O)C/C=C\[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL355625
Phase Preclinical
Structure Type MOL
InChI Key UYUVJSRSLLBWOG-OTOQAYLJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

664.9
MW (Da)
5.20
ALogP
6
HBA
5
HBD
145.9
PSA (Ų)
0.14
QED
2
Ro5 Violations
18
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H56N4O6
MW 664.89
Aromatic Rings 2
Heavy Atoms 48
NP-Likeness 0.14

Literature References

PubMed DOI Target Context # Activities
2405159 10.1021/jm00164a058 Renin 1

Data from ChEMBL 36 via Core Engine