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Compound Detail

CHEMBL5316050

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Cc1ccc2oc(=O)c(-c3nc4cc(C5=NCCCN5)ccc4[nH]3)c(Cl)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5316050
Phase Preclinical
Structure Type MOL
InChI Key FZRZNRPICRGWDL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.9
MW (Da)
4.04
ALogP
5
HBA
2
HBD
83.3
PSA (Ų)
0.50
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H17ClN4O2
MW 392.85
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -0.61

Data from ChEMBL 36 via Core Engine