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Compound Detail

CHEMBL1733477

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O=C(NC(=S)Nc1cccc2cccnc12)c1cccs1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1733477
Phase Preclinical
Structure Type MOL
InChI Key XDHSYBVDZZESJO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

313.4
MW (Da)
3.42
ALogP
4
HBA
2
HBD
54.0
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11N3OS2
MW 313.41
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -2.54

Data from ChEMBL 36 via Core Engine