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Compound Detail

CHEMBL3765957

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CCN(CC)Cc1cc(/C=C2\CNC/C(=C\c3ccc(O)c(CN(CC)CC)c3)C2=O)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3765957
Phase Preclinical
Structure Type MOL
InChI Key ORABGBLYCIKVLS-RNIAWFEPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

477.6
MW (Da)
4.42
ALogP
6
HBA
3
HBD
76.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H39N3O3
MW 477.65
Aromatic Rings 2
Heavy Atoms 35
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine