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Compound Detail

CHEMBL1191316

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CCOC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191316
Phase Preclinical
Structure Type MOL
InChI Key ANDFTXFGKWBAGA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

581.6
MW (Da)
5.42
ALogP
10
HBA
1
HBD
124.1
PSA (Ų)
0.17
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H31N3O7
MW 581.63
Aromatic Rings 5
Heavy Atoms 43
NP-Likeness -0.67

Data from ChEMBL 36 via Core Engine