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Compound Detail

CHEMBL1456172

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Cc1ccc(-n2c(=O)[nH]cc(C(=O)Nc3ccc4c(c3)OCCO4)c2=O)cc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1456172
Phase Preclinical
Structure Type MOL
InChI Key AYDRQXWCJIQSOB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

393.4
MW (Da)
2.17
ALogP
6
HBA
2
HBD
102.4
PSA (Ų)
0.71
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 C21H19N3O5
MW 393.40
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.55

Data from ChEMBL 36 via Core Engine