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Compound Detail

CHEMBL2004013

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Cc1ccc(-c2csc3nnc(SCCOc4ccccc4)n23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2004013
Phase Preclinical
Structure Type MOL
InChI Key SUSDASYPMCOYOJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

367.5
MW (Da)
4.94
ALogP
6
HBA
0
HBD
39.4
PSA (Ų)
0.36
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17N3OS2
MW 367.50
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -2.16

Data from ChEMBL 36 via Core Engine