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Compound Detail

CHEMBL6040106

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CN1CCC2(CC1)NC(=O)c1c(Cl)cc(Nc3ccncn3)c(=O)n12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6040106
Phase Preclinical
Structure Type MOL
InChI Key ZRTRQXQCCPEDSY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

360.8
MW (Da)
1.16
ALogP
7
HBA
2
HBD
92.2
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H17ClN6O2
MW 360.81
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.94

Data from ChEMBL 36 via Core Engine