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Compound Detail

CHEMBL6069475

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NCCNc1c2c(c(NCCN)c3nsnc13)C(=O)c1ccccc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069475
Phase Preclinical
Structure Type MOL
InChI Key KKOGPRGRCBTRER-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

382.4
MW (Da)
1.21
ALogP
9
HBA
4
HBD
136.0
PSA (Ų)
0.37
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H18N6O2S
MW 382.45
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.41

Data from ChEMBL 36 via Core Engine