Compound Detail

CHEMBL4301748

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CCN(CC)c1ccc2c(-c3ccccc3C(=O)O[C@H]3CC[C@]4(C)[C@H]5C(=O)C=C6[C@@H]7C[C@@](C)(C(=O)OC)CC[C@]7(C)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)c3ccc(=[N+](CC)CC)cc-3oc2c1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL4301748
Phase	Preclinical
Structure Type	MOL
InChI Key	YHZNXZPYAUFOJG-GQJCKNCYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

910.3

MW (Da)

12.54

ALogP

HBA

HBD

89.1

PSA (Å²)

0.09

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C59H77N2O6+
MW	910.27
Aromatic Rings	2
Heavy Atoms	67
NP-Likeness	1.49

Data from ChEMBL 36 via Core Engine