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Compound Detail

CHEMBL3306874

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CC(C)=CCC/C(C)=C/C[N+](C)(C)CCOC1C2CC3CC(C2)CC1C3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3306874
Phase Preclinical
Structure Type MOL
InChI Key XXHNTSYKNVAAAT-DJKKODMXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

360.6
MW (Da)
5.60
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.38
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H42NO+
MW 360.61
Aromatic Rings 0
Heavy Atoms 26
NP-Likeness 1.20

Data from ChEMBL 36 via Core Engine