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Compound Detail

CHEMBL1192002

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CN1C(=O)CN2Cc3c(sc4c3CCCC4)N=C21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1192002
Phase Preclinical
Structure Type MOL
InChI Key JHLNTNWDIIHAJL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

261.4
MW (Da)
1.90
ALogP
4
HBA
0
HBD
35.9
PSA (Ų)
0.71
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 C13H15N3OS
MW 261.35
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.07

Data from ChEMBL 36 via Core Engine