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Compound Detail

CHEMBL1189704

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O=C1CN2Cc3c(-c4ccccc4)csc3NC2=N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189704
Phase Preclinical
Structure Type MOL
InChI Key VVLKMCWSHDAOMK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

269.3
MW (Da)
2.54
ALogP
4
HBA
1
HBD
44.7
PSA (Ų)
0.86
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11N3OS
MW 269.33
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine