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Compound Detail

CHEMBL3140138

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Cc1c(P(=S)(c2ccccc2)c2ccccc2)n2ccccc2[n+]1C/C=C/c1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3140138
Phase Preclinical
Structure Type MOL
InChI Key KZBYHVDBXJGQRD-OUKQBFOZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

515.6
MW (Da)
6.16
ALogP
2
HBA
0
HBD
8.3
PSA (Ų)
0.19
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H28N2PS+
MW 515.64
Aromatic Rings 6
Heavy Atoms 37
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine