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Compound Detail

CHEMBL1183014

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CCCN(CCC)CCc1ccccc1OCCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183014
Phase Preclinical
Structure Type MOL
InChI Key GCZNMJYMLHINBH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

325.5
MW (Da)
4.97
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H31NO
MW 325.50
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.77

Data from ChEMBL 36 via Core Engine