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Compound Detail

CHEMBL5190518

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C=C(C)c1cnc(Nc2ccc(N3CCC4(CC3)CN(C)C4)cc2)nc1Nc1ccccc1P(C)(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5190518
Phase Preclinical
Structure Type MOL
InChI Key XIDHYQKOARJHSQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

516.6
MW (Da)
5.78
ALogP
7
HBA
2
HBD
73.4
PSA (Ų)
0.39
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H37N6OP
MW 516.63
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness -0.93

Literature References

PubMed DOI Target Context # Activities
34323489 10.1021/acs.jmedchem.1c00876 Unchecked 2

Data from ChEMBL 36 via Core Engine