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Compound Detail

CHEMBL2364769

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CCOC(=O)N[C@@H](C)C(=O)N[C@@H](CC1CCNC1=O)C(O)(C(=O)NC1CC1)S(=O)(=O)O

Basic Information

ChEMBL ID CHEMBL2364769
Phase Preclinical
Structure Type MOL
InChI Key IPKGKBQCHZKZST-UOOYEHOZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

464.5
MW (Da)
-2.01
ALogP
8
HBA
6
HBD
200.2
PSA (Ų)
0.20
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H28N4O9S
MW 464.50
Aromatic Rings 0
Heavy Atoms 31
NP-Likeness -0.12

Data from ChEMBL 36 via Core Engine