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Compound Detail

CHEMBL5499664

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N=C(N)c1ccc2nc(C3CCC(c4nc5ccc(C(=N)N)cc5s4)CC3)sc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499664
Phase Preclinical
Structure Type MOL
InChI Key LOZXXMZSPNSADH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

434.6
MW (Da)
4.92
ALogP
6
HBA
4
HBD
125.5
PSA (Ų)
0.27
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H22N6S2
MW 434.59
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine