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Compound Detail

CHEMBL1188457

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NCc1c(OCCCCO)cncc1OCCCCO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1188457
Phase Preclinical
Structure Type MOL
InChI Key ZIFSFSGSTPMCOJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

284.4
MW (Da)
0.84
ALogP
6
HBA
3
HBD
97.8
PSA (Ų)
0.52
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H24N2O4
MW 284.36
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.09

Data from ChEMBL 36 via Core Engine