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Compound Detail

CHEMBL1206633

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O=C(O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206633
Phase Preclinical
Structure Type MOL
InChI Key SMIJCZLORYPMIE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.5
MW (Da)
2.88
ALogP
4
HBA
1
HBD
53.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H28N2O3
MW 368.48
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine