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Compound Detail

CHEMBL73417

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O=C(NCCN1CCCCC1)C(c1ccccc1)C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL73417
Phase Preclinical
Structure Type MOL
InChI Key KFLCQGDXXUKTRK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

328.5
MW (Da)
3.95
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.86
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H32N2O
MW 328.50
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine