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Compound Detail

CHEMBL5826919

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CN1Cc2c(Cl)cc(Cl)cc2[C@H](c2ccc(S(=O)(=O)NCCOCCOCCN)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5826919
Phase Preclinical
Structure Type MOL
InChI Key NRIZIJVJMCOSCR-FQEVSTJZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

502.5
MW (Da)
2.84
ALogP
6
HBA
2
HBD
93.9
PSA (Ų)
0.46
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H29Cl2N3O4S
MW 502.46
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine