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Compound Detail

CHEMBL51621

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CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL51621
Phase Preclinical
Structure Type BOTH
InChI Key HVPPEXXUDXAPOM-MGHWNKPDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

407.5
MW (Da)
1.41
ALogP
5
HBA
5
HBD
141.8
PSA (Ų)
0.38
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C21H33N3O5
MW 407.51
Aromatic Rings 1
Heavy Atoms 29
NP-Likeness 0.41

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80059-1 Unchecked 1
- 10.1016/S0960-894X(00)80059-1 Mus musculus 1

Data from ChEMBL 36 via Core Engine