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Compound Detail

CHEMBL1185885

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CN(C)CCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185885
Phase Preclinical
Structure Type MOL
InChI Key LIGUVABQIBSCLO-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
3.27
ALogP
2
HBA
2
HBD
34.9
PSA (Ų)
0.57
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 C20H23N4+
MW 319.43
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -0.07

Data from ChEMBL 36 via Core Engine