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Compound Detail

CHEMBL1189870

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c1ccc(CC2CCN(CCCN3CCCCC3)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189870
Phase Preclinical
Structure Type MOL
InChI Key IPPNTNSKOLFICB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

300.5
MW (Da)
3.82
ALogP
2
HBA
0
HBD
6.5
PSA (Ų)
0.79
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 C20H32N2
MW 300.49
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.71

Data from ChEMBL 36 via Core Engine