Compound Detail

CHEMBL4302595

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CC[C@@H](C(=O)[C@@H](C)[C@@H](O)[C@H](C)[C@@H]1O[C@@H]([C@@H](CC)C(=O)O)CC[C@@H]1C)[C@H]1O[C@]2(C=C[C@H](NC(=O)c3ccco3)[C@]3(CC[C@@](C)([C@H]4CC[C@](O)(CC)[C@H](C)O4)O3)O2)[C@H](C)C[C@@H]1C

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL4302595
Phase	Preclinical
Structure Type	MOL
InChI Key	VOBNOGUNZKTLGK-DKIWJJLQSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

844.1

MW (Da)

7.22

ALogP

HBA

HBD

183.2

PSA (Å²)

0.14

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C47H73NO12
MW	844.10
Aromatic Rings	1
Heavy Atoms	60
NP-Likeness	1.62

Data from ChEMBL 36 via Core Engine