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Compound Detail

CHEMBL64527

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O=C(CCCCCC(=O)Nc1ccc(S(=O)(=O)O)c2cccc(S(=O)(=O)O)c12)Nc1ccc(S(=O)(=O)O)c2cccc(S(=O)(=O)O)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL64527
Phase Preclinical
Structure Type MOL
InChI Key MAUQCTPKDBPNCZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

730.8
MW (Da)
3.51
ALogP
10
HBA
6
HBD
275.7
PSA (Ų)
0.09
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H26N2O14S4
MW 730.77
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -0.42

Data from ChEMBL 36 via Core Engine