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Compound Detail

CHEMBL1625287

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CCCCCCCCCC[N+](C)(C)CC/C=C1/c2ccccc2Sc2ccc(Cl)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1625287
Phase Preclinical
Structure Type MOL
InChI Key WKPFAGPWDYWJJR-JLPGSUDCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

457.1
MW (Da)
8.84
ALogP
1
HBA
0
HBD
0.0
PSA (Ų)
0.19
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H39ClNS+
MW 457.15
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.18

Data from ChEMBL 36 via Core Engine