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Compound Detail

CHEMBL1194695

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Nc1nc(N)nc(NCCCNCCCCCCCCCCCCNCCCNc2nc(N)nc(N)n2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194695
Phase Preclinical
Structure Type MOL
InChI Key XGULLELKDXOPFT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

532.8
MW (Da)
1.77
ALogP
14
HBA
8
HBD
229.5
PSA (Ų)
0.10
QED
3
Ro5 Violations
23
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H48N14
MW 532.75
Aromatic Rings 2
Heavy Atoms 38
NP-Likeness -0.38

Data from ChEMBL 36 via Core Engine