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Compound Detail

CHEMBL12562

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CCCN(CCC)C1Cc2cccc3c2N(C1)C(=O)OC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL12562
Phase Preclinical
Structure Type MOL
InChI Key JVXNCHSKAILTQZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

288.4
MW (Da)
3.19
ALogP
3
HBA
0
HBD
32.8
PSA (Ų)
0.83
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H24N2O2
MW 288.39
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.69

Data from ChEMBL 36 via Core Engine