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Compound Detail

CHEMBL5498631

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c1cc2nc(C3CCC(c4nc5ccc(C6=NCCN6)cc5s4)CC3)sc2cc1C1=NCCN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498631
Phase Preclinical
Structure Type MOL
InChI Key XYQCXTSKYLIXCL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

486.7
MW (Da)
5.05
ALogP
8
HBA
2
HBD
74.6
PSA (Ų)
0.42
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H26N6S2
MW 486.67
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine