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Compound Detail

CHEMBL1193813

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CN(C)c1nc(NCCCNCCCCCCCCCCCCNCCCN)nc(N(C)C)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193813
Phase Preclinical
Structure Type MOL
InChI Key QYVYFGUQPUDZCD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

479.8
MW (Da)
3.23
ALogP
9
HBA
4
HBD
107.3
PSA (Ų)
0.18
QED
0
Ro5 Violations
23
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H53N9
MW 479.76
Aromatic Rings 1
Heavy Atoms 34
NP-Likeness -0.44

Data from ChEMBL 36 via Core Engine