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Compound Detail

CHEMBL3651303

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N#Cc1c[nH]c(C(=O)Nc2ccc(C3COC(=O)OC3)cc2C2=CCCCC2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3651303
Phase Preclinical
Structure Type MOL
InChI Key XYJXOUNWIAVITJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.4
MW (Da)
3.74
ALogP
6
HBA
2
HBD
117.1
PSA (Ų)
0.77
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 C21H20N4O4
MW 392.42
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.29

Data from ChEMBL 36 via Core Engine