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Compound Detail

CHEMBL1185259

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OC(CCCN1CCN(c2ccccc2)CC1)(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185259
Phase Preclinical
Structure Type MOL
InChI Key JNPRCINFURKLMG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
4.52
ALogP
3
HBA
1
HBD
26.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H30N2O
MW 386.54
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.84

Data from ChEMBL 36 via Core Engine