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Compound Detail

CHEMBL1852205

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NC1=NC2(CCCCC2)N(OCCCOc2ccccc2)C(N)=N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1852205
Phase Preclinical
Structure Type MOL
InChI Key SKLBDXCGGPLAAM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

331.4
MW (Da)
1.99
ALogP
7
HBA
2
HBD
98.5
PSA (Ų)
0.78
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 C17H25N5O2
MW 331.42
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.18

Data from ChEMBL 36 via Core Engine