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Compound Detail

CHEMBL2370260

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CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2370260
Phase Preclinical
Structure Type BOTH
InChI Key CAIQQUVRJSDGFK-FIQMJTIWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

729.9
MW (Da)
1.18
ALogP
8
HBA
9
HBD
261.9
PSA (Ų)
0.09
QED
2
Ro5 Violations
21
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H55N7O9
MW 729.88
Aromatic Rings 2
Heavy Atoms 52
NP-Likeness 0.15

Literature References

PubMed DOI Target Context # Activities
10956190 10.1021/jm990432o Gonadotropin-releasing hormone receptor 1

Data from ChEMBL 36 via Core Engine