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Compound Detail

CHEMBL1626659

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N#CN/C(=N\CCCCCCOc1ccc(Cl)cc1)Nc1cc[n+](COC(=O)NCCCN)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1626659
Phase Preclinical
Structure Type MOL
InChI Key BRVDNNYPSHDNEU-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

503.0
MW (Da)
3.14
ALogP
6
HBA
4
HBD
137.7
PSA (Ų)
0.08
QED
1
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H33ClN7O3+
MW 503.03
Aromatic Rings 2
Heavy Atoms 35
NP-Likeness -0.62

Data from ChEMBL 36 via Core Engine