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Compound Detail

CHEMBL1621230

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Cc1cc2[nH]c3c(c[n+](C)c4ccccc34)c2cc1C

Basic Information

ChEMBL ID CHEMBL1621230
Phase Preclinical
Structure Type MOL
InChI Key VWKXPFOCCSQQOA-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

261.4
MW (Da)
3.92
ALogP
0
HBA
1
HBD
19.7
PSA (Ų)
0.46
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H17N2+
MW 261.35
Aromatic Rings 4
Heavy Atoms 20
NP-Likeness 0.35

Data from ChEMBL 36 via Core Engine