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Compound Detail

CHEMBL378267

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NCC(=O)N[C@@H](Cc1ccccc1)C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL378267
Phase Preclinical
Structure Type MOL
InChI Key PSPZOKPNYCSKSW-VIFPVBQESA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

221.3
MW (Da)
-0.84
ALogP
3
HBA
3
HBD
98.2
PSA (Ų)
0.60
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H15N3O2
MW 221.26
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.39

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
16759105 10.1021/jm0511029 Solute carrier family 15 member 1 2
19060912 10.1038/nchembio.132 General amino-acid permease GAP1 2
3941405 10.1021/jm00151a018 Dipeptidyl peptidase 1 1

Data from ChEMBL 36 via Core Engine