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Compound Detail

CHEMBL4597766

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N=C(N)N(CCCCCCCOc1ccccc1)Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597766
Phase Preclinical
Structure Type MOL
InChI Key QNOZFSYNHYMELP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

339.5
MW (Da)
4.41
ALogP
2
HBA
2
HBD
62.3
PSA (Ų)
0.36
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H29N3O
MW 339.48
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.57

Data from ChEMBL 36 via Core Engine