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Compound Detail

CHEMBL4596903

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CC(=O)N1CCC(OC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)c2nc3ccccc3s2)CC1

Basic Information

ChEMBL ID CHEMBL4596903
Phase Preclinical
Structure Type MOL
InChI Key QGHPTZNADRNLAZ-SFTDATJTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

573.7
MW (Da)
2.38
ALogP
8
HBA
5
HBD
179.6
PSA (Ų)
0.11
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H39N7O5S
MW 573.72
Aromatic Rings 2
Heavy Atoms 40
NP-Likeness -0.60

Data from ChEMBL 36 via Core Engine