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Compound Detail

CHEMBL5806976

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Nc1ncnc2c1c(-c1ccc3oc(-c4ccccc4)nc3c1)nn2CC1CCNCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5806976
Phase Preclinical
Structure Type MOL
InChI Key BAHBWNCWOQNDCG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

425.5
MW (Da)
3.88
ALogP
8
HBA
2
HBD
107.7
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H23N7O
MW 425.50
Aromatic Rings 5
Heavy Atoms 32
NP-Likeness -1.11

Data from ChEMBL 36 via Core Engine