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Compound Detail

CHEMBL5028806

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CC(=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1

Basic Information

ChEMBL ID CHEMBL5028806
Phase Preclinical
Structure Type MOL
InChI Key PDEIQJDUHQRSQF-DODOAAEWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

788.0
MW (Da)
1.81
ALogP
10
HBA
7
HBD
208.3
PSA (Ų)
0.07
QED
2
Ro5 Violations
18
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C41H61N11O5
MW 788.01
Aromatic Rings 2
Heavy Atoms 57
NP-Likeness -0.49

Data from ChEMBL 36 via Core Engine