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Compound Detail

CHEMBL5499930

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O=C(Nc1ccc(N=C2NCCN2)cn1)c1ccc(N=C2NCCN2)cn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499930
Phase Preclinical
Structure Type MOL
InChI Key SSJZLPBFNQPXJE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

365.4
MW (Da)
0.09
ALogP
5
HBA
5
HBD
127.7
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H19N9O
MW 365.40
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.05

Data from ChEMBL 36 via Core Engine