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Compound Detail

CHEMBL3765840

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O=C(CCCCCN1CCCC1)n1c2ccccc2c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3765840
Phase Preclinical
Structure Type MOL
InChI Key NGTFELHMQLBGSF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

334.5
MW (Da)
5.09
ALogP
3
HBA
0
HBD
25.2
PSA (Ų)
0.59
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H26N2O
MW 334.46
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.62

Data from ChEMBL 36 via Core Engine