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Compound Detail

CHEMBL1178932

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CCCN(CCCCN1C(=O)C2CCCC2C1=O)C1COc2cccc(OC)c2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178932
Phase Preclinical
Structure Type MOL
InChI Key PEJFBWCDCTVGLS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

414.6
MW (Da)
3.28
ALogP
5
HBA
0
HBD
59.1
PSA (Ų)
0.46
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 C24H34N2O4
MW 414.55
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine