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Compound Detail

CHEMBL56718

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Cc1nccn1CCCCNC(=O)c1ccc2nc3ccc(C(C)C)cc3c(=O)n2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL56718
Phase Preclinical
Structure Type MOL
InChI Key HXAIEPAJUDSFBB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

417.5
MW (Da)
3.69
ALogP
6
HBA
1
HBD
81.3
PSA (Ų)
0.37
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H27N5O2
MW 417.51
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -1.76

Data from ChEMBL 36 via Core Engine