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Compound Detail

CHEMBL4595098

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C(=N/Nc1c2c(nc3ccccc13)CCCC2)\c1ccc(OCc2cn(Cc3ccccc3)nn2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595098
Phase Preclinical
Structure Type MOL
InChI Key UPFUAMRNRBIMEV-FDAWAROLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

488.6
MW (Da)
5.78
ALogP
7
HBA
1
HBD
77.2
PSA (Ų)
0.22
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H28N6O
MW 488.60
Aromatic Rings 5
Heavy Atoms 37
NP-Likeness -1.55

Data from ChEMBL 36 via Core Engine