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Compound Detail

CHEMBL1186978

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Oc1cc2c(c(-c3ccc4ccccc4c3)c1O)CCNCC2c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186978
Phase Preclinical
Structure Type MOL
InChI Key IYCKJBWHPUVVIA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

381.5
MW (Da)
5.20
ALogP
3
HBA
3
HBD
52.5
PSA (Ų)
0.42
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23NO2
MW 381.48
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness 0.62

Data from ChEMBL 36 via Core Engine