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Compound Detail

CHEMBL528077

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Cc1ccccc1CCNC(=O)c1cnc(N2CCN(c3ccncc3)CC2)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL528077
Phase Preclinical
Structure Type MOL
InChI Key CDHCGELEODEFBI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

436.0
MW (Da)
3.74
ALogP
5
HBA
1
HBD
61.4
PSA (Ų)
0.64
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 C24H26ClN5O
MW 435.96
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.72

Data from ChEMBL 36 via Core Engine