Compound Detail

CHEMBL217629

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CC(=O)N[C@@H](Cc1cn(C=O)c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL217629
Phase	Preclinical
Structure Type	MOL
InChI Key	ZPHZCFVFBFIFBT-FUJLPNNASA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

949.1

MW (Da)

1.84

ALogP

HBA

HBD

259.6

PSA (Å²)

0.05

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C52H56N10O8
MW	949.08
Aromatic Rings	6
Heavy Atoms	70
NP-Likeness	-0.22

Literature References

PubMed	DOI	Target Context	# Activities
3275777	10.1021/jm00396a006	Renin	1

Data from ChEMBL 36 via Core Engine