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Compound Detail

CHEMBL1192004

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O=C1CN2Cc3c(sc4c3CC(O)CC4)N=C2N1

Basic Information

ChEMBL ID CHEMBL1192004
Phase Preclinical
Structure Type MOL
InChI Key KJXHFJXOGPMJFD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

263.3
MW (Da)
0.53
ALogP
5
HBA
2
HBD
64.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H13N3O2S
MW 263.32
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.31

Data from ChEMBL 36 via Core Engine