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Compound Detail

CHEMBL4300783

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CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1NC(=O)CCCCC[n+]1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300783
Phase Preclinical
Structure Type MOL
InChI Key KCDGYAFZTGNCQY-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

481.6
MW (Da)
4.11
ALogP
6
HBA
4
HBD
128.6
PSA (Ų)
0.24
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 C26H33N4O5+
MW 481.57
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.26

Data from ChEMBL 36 via Core Engine