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Compound Detail

CHEMBL5988889

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CCC1(C)NCCc2cc(Nc3ncc(Cl)c(Nc4ccccc4S(=O)(=O)C(C)C)n3)c(OC)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5988889
Phase Preclinical
Structure Type MOL
InChI Key NVWLOTOCZPTCKH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

530.1
MW (Da)
5.58
ALogP
8
HBA
3
HBD
105.2
PSA (Ų)
0.35
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32ClN5O3S
MW 530.09
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine