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Compound Detail

CHEMBL1182812

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CC(CN(C)C)Nc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182812
Phase Preclinical
Structure Type MOL
InChI Key ZUPYJOSFWLHERQ-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

333.5
MW (Da)
3.66
ALogP
2
HBA
2
HBD
34.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H25N4+
MW 333.46
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness 0.03

Data from ChEMBL 36 via Core Engine