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Compound Detail

CHEMBL1197279

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CC[N+](C)(CC)Cc1cc(/N=c2\ccn(C)c(C)c2)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197279
Phase Preclinical
Structure Type MOL
InChI Key XZLCAPXYBZECRX-CZIZESTLSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

314.4
MW (Da)
3.26
ALogP
3
HBA
1
HBD
37.5
PSA (Ų)
0.85
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 C19H28N3O+
MW 314.45
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.07

Data from ChEMBL 36 via Core Engine