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Compound Detail

CHEMBL27803

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

Basic Information

ChEMBL ID CHEMBL27803
Phase Preclinical
Structure Type MOL
InChI Key FFVIWVMEKHYVNS-RYRKJORJSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

369.6
MW (Da)
2.26
ALogP
4
HBA
3
HBD
101.3
PSA (Ų)
0.49
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H39N3O3
MW 369.55
Aromatic Rings 0
Heavy Atoms 26
NP-Likeness 0.08

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
2566685 10.1021/jm00126a039 Leucyl-cystinyl aminopeptidase 2
2566685 10.1021/jm00126a039 Aminopeptidase B 1

Data from ChEMBL 36 via Core Engine