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Compound Detail

CHEMBL5222831

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Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5222831
Phase Preclinical
Structure Type MOL
InChI Key ZKKBZRDZTBXDKE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

366.5
MW (Da)
2.61
ALogP
4
HBA
3
HBD
105.3
PSA (Ų)
0.39
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H30N6OS
MW 366.54
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness -0.86

Data from ChEMBL 36 via Core Engine