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Compound Detail

CHEMBL5221507

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O=C(O)c1cc(-c2ccc(CN(Cc3ccccc3)Cc3ccc(-c4ccc(O)c(C(=O)O)c4)o3)o2)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221507
Phase Preclinical
Structure Type MOL
InChI Key PGBLOPHSEPJSRZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

539.5
MW (Da)
6.22
ALogP
7
HBA
4
HBD
144.6
PSA (Ų)
0.16
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H25NO8
MW 539.54
Aromatic Rings 5
Heavy Atoms 40
NP-Likeness -0.47

Data from ChEMBL 36 via Core Engine