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Compound Detail

CHEMBL1191772

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CCN(CC)CCOC(=O)C1(c2ccc(N3CCCC3)cc2)CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191772
Phase Preclinical
Structure Type MOL
InChI Key PXBMYTXCOCGUQU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

358.5
MW (Da)
3.98
ALogP
4
HBA
0
HBD
32.8
PSA (Ų)
0.66
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H34N2O2
MW 358.53
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -1.04

Data from ChEMBL 36 via Core Engine