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Compound Detail

CHEMBL167067

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CN(C)CCNC(=O)c1cccc2[nH]c(-c3ccco3)nc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL167067
Phase Preclinical
Structure Type MOL
InChI Key FSDAXDKKZCVWHR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
2.11
ALogP
4
HBA
2
HBD
74.2
PSA (Ų)
0.76
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 C16H18N4O2
MW 298.35
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.64

Data from ChEMBL 36 via Core Engine