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Compound Detail

CHEMBL1741092

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Nc1c(S(=O)(=O)O)cc(Nc2ccc(O)c(C(=O)O)c2)c2c1C(=O)c1ccccc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1741092
Phase Preclinical
Structure Type MOL
InChI Key KSXUGSOTPZRKPL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

454.4
MW (Da)
2.44
ALogP
8
HBA
5
HBD
184.1
PSA (Ų)
0.17
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H14N2O8S
MW 454.42
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine