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Compound Detail

CHEMBL4301749

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CC(=N)NCc1cccc(CNC(=O)[C@@H](N)[C@@H](C)O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4301749
Phase Preclinical
Structure Type MOL
InChI Key SMDOPCRUNFVYSO-RNCFNFMXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

278.4
MW (Da)
0.10
ALogP
4
HBA
5
HBD
111.2
PSA (Ų)
0.38
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H22N4O2
MW 278.36
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.07

Data from ChEMBL 36 via Core Engine