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Compound Detail

CHEMBL1178554

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CC(OC[n+]1ccn(C)c1/C=N/O)C(C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178554
Phase Preclinical
Structure Type MOL
InChI Key ZFCHOIXDYDKFFE-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

240.3
MW (Da)
1.53
ALogP
4
HBA
1
HBD
50.6
PSA (Ų)
0.38
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H22N3O2+
MW 240.33
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.09

Data from ChEMBL 36 via Core Engine