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Compound Detail

CHEMBL1621699

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CC(C)CC1CCCCC1OC(=O)C[N+]1(C)CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1621699
Phase Preclinical
Structure Type MOL
InChI Key UGRGSQHXKZRSIZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

296.5
MW (Da)
3.77
ALogP
2
HBA
0
HBD
26.3
PSA (Ų)
0.57
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 C18H34NO2+
MW 296.48
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness 0.67

Data from ChEMBL 36 via Core Engine