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Compound Detail

CHEMBL1184137

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Nc1cccc(N2C(=O)N(c3cccc(N)c3)[C@H](Cc3ccccc3)[C@H](O)[C@@H](O)[C@H]2Cc2ccccc2)c1

Basic Information

ChEMBL ID CHEMBL1184137
Phase Preclinical
Structure Type MOL
InChI Key QIYYXOKVPKQFJU-XAZDILKDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

508.6
MW (Da)
4.24
ALogP
5
HBA
4
HBD
116.0
PSA (Ų)
0.29
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H32N4O3
MW 508.62
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -0.10

Data from ChEMBL 36 via Core Engine