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Compound Detail

CHEMBL1622930

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Cc1c(P(=S)(c2ccccc2)c2ccccc2)n2ccccc2[n+]1C/C=C/c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1622930
Phase Preclinical
Structure Type MOL
InChI Key VSWYSDPXUHVQCG-DTQAZKPQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

465.6
MW (Da)
5.00
ALogP
2
HBA
0
HBD
8.3
PSA (Ų)
0.25
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H26N2PS+
MW 465.58
Aromatic Rings 5
Heavy Atoms 33
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine