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Compound Detail

CHEMBL3559307

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O=C(N[C@@H](CC1CCCCC1)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(O)S(=O)(=O)O)OCc1cccc(Cl)c1

Basic Information

ChEMBL ID CHEMBL3559307
Phase Preclinical
Structure Type MOL
InChI Key LWEMXRPZTDJXNH-AYPAZXDVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

560.1
MW (Da)
2.12
ALogP
7
HBA
5
HBD
171.1
PSA (Ų)
0.26
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H34ClN3O8S
MW 560.07
Aromatic Rings 1
Heavy Atoms 37
NP-Likeness -0.05

Data from ChEMBL 36 via Core Engine