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Compound Detail

CHEMBL4802708

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C=C1CN(S(=O)(=O)c2ccc(C)cc2)CCc2cc(CCCC)cc(n2)CCN(S(=O)(=O)c2ccc(C)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4802708
Phase Preclinical
Structure Type MOL
InChI Key MVFLEHOHEFKWGS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

581.8
MW (Da)
5.08
ALogP
5
HBA
0
HBD
87.7
PSA (Ų)
0.36
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H39N3O4S2
MW 581.80
Aromatic Rings 3
Heavy Atoms 40
NP-Likeness -0.44

Data from ChEMBL 36 via Core Engine