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Compound Detail

CHEMBL5500072

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CCCNc1ccc(NCCN)c2c1C(=O)c1ccncc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5500072
Phase Preclinical
Structure Type MOL
InChI Key QUJHNLMVGUCEKH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
2.05
ALogP
6
HBA
3
HBD
97.1
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H20N4O2
MW 324.38
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.24

Data from ChEMBL 36 via Core Engine