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Compound Detail

CHEMBL4300710

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COc1ccc(N2CCN(CCCOc3c(C)cc(C)cc3C)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300710
Phase Preclinical
Structure Type MOL
InChI Key MGOVFKYGYIQOQX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.5
MW (Da)
4.21
ALogP
4
HBA
0
HBD
24.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H32N2O2
MW 368.52
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.16

Data from ChEMBL 36 via Core Engine