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Compound Detail

CHEMBL4116022

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CN(C/C=C/c1ccc(-c2ccccc2)cc1)Cc1ccc2c(c1)CCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4116022
Phase Preclinical
Structure Type MOL
InChI Key ZEMGIFYMXPOXAV-AATRIKPKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

355.5
MW (Da)
5.43
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.58
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H25NO
MW 355.48
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine