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Compound Detail

CHEMBL1196970

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NC1CCC(NCCCCNCc2c3ccccc3cc3ccccc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196970
Phase Preclinical
Structure Type MOL
InChI Key WZMGVGQCDBCNHZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

375.6
MW (Da)
4.72
ALogP
3
HBA
3
HBD
50.1
PSA (Ų)
0.39
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H33N3
MW 375.56
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.34

Data from ChEMBL 36 via Core Engine