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Compound Detail

CHEMBL1497766

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O=C(CSc1nc(O)c(Cc2ccccc2)c(O)n1)Nc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1497766
Phase Preclinical
Structure Type MOL
InChI Key OBBIKVAJNYZMOC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

367.4
MW (Da)
3.21
ALogP
6
HBA
3
HBD
95.3
PSA (Ų)
0.46
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 C19H17N3O3S
MW 367.43
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.41

Data from ChEMBL 36 via Core Engine