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Compound Detail

CHEMBL1190385

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O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(F)cc2)sc2cc(O)ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190385
Phase Preclinical
Structure Type MOL
InChI Key HKOBHPSQGCLOAD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

475.6
MW (Da)
6.51
ALogP
5
HBA
1
HBD
49.8
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H26FNO3S
MW 475.59
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.84

Data from ChEMBL 36 via Core Engine