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Compound Detail

CHEMBL5315274

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N=C(N)N/N=C\c1ccc(-c2cccc(-c3ccc(/C=N/NC(=N)N)cc3)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5315274
Phase Preclinical
Structure Type MOL
InChI Key LRQCOQKVMDNNTF-DYCUMYEBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

398.5
MW (Da)
2.65
ALogP
4
HBA
6
HBD
148.5
PSA (Ų)
0.21
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H22N8
MW 398.47
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -0.66

Data from ChEMBL 36 via Core Engine