Compound Detail

CHEMBL1187542

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Cc1cn([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](n4ccc(=O)[nH]c4=O)C[C@@H]3O)[C@@H](C(=O)NCCN[C@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O2)c(=O)[nH]c1=O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL1187542
Phase	Preclinical
Structure Type	MOL
InChI Key	IYKPMFDMGHLPTF-LRMPWKKUSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

892.8

MW (Da)

-7.56

ALogP

HBA

HBD

428.5

PSA (Å²)

0.06

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C33H53N10O17P
MW	892.81
Aromatic Rings	2
Heavy Atoms	61
NP-Likeness	0.78

Data from ChEMBL 36 via Core Engine