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Compound Detail

CHEMBL1446100

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Cc1nnc(NC(=O)C2C3C=CC(O3)C2C(=O)O)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1446100
Phase Preclinical
Structure Type MOL
InChI Key NQNCLYCHYSUUSL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

281.3
MW (Da)
0.44
ALogP
6
HBA
2
HBD
101.4
PSA (Ų)
0.78
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H11N3O4S
MW 281.29
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -1.25

Data from ChEMBL 36 via Core Engine