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Compound Detail

CHEMBL90670

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NC(=O)CC[C@H](N)C(=O)NCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL90670
Phase Preclinical
Structure Type MOL
InChI Key JEFZIKRIDLHOIF-BYPYZUCNSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

203.2
MW (Da)
-2.22
ALogP
4
HBA
4
HBD
135.5
PSA (Ų)
0.39
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C7H13N3O4
MW 203.20
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.30

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
7629809 10.1021/jm00014a022 Angiotensin-converting enzyme 1
6127409 10.1021/jm00351a003 Unchecked 1

Data from ChEMBL 36 via Core Engine