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Compound Detail

CHEMBL3990954

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Cc1cccc(OCCN2CCN(c3ccccc3)CC2)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3990954
Phase Preclinical
Structure Type MOL
InChI Key ZYJCJCHMCYDVCE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

310.4
MW (Da)
3.50
ALogP
3
HBA
0
HBD
15.7
PSA (Ų)
0.84
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 C20H26N2O
MW 310.44
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.51

Data from ChEMBL 36 via Core Engine