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Compound Detail

CHEMBL1715251

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Cc1cccc(S(=O)(=O)NCc2ccc(C(=O)NCCN3Cc4ccccc4C3)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1715251
Phase Preclinical
Structure Type MOL
InChI Key NZUAOVNQGWISMA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

449.6
MW (Da)
3.22
ALogP
4
HBA
2
HBD
78.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27N3O3S
MW 449.58
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.79

Data from ChEMBL 36 via Core Engine