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Compound Detail

CHEMBL5867080

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O=C1NC2(CCCCC2)n2c1c(Cl)cc(Nc1ncnc3[nH]ncc13)c2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5867080
Phase Preclinical
Structure Type MOL
InChI Key RWALTXNCWCAKGV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

385.8
MW (Da)
2.27
ALogP
7
HBA
3
HBD
117.6
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16ClN7O2
MW 385.82
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.11

Data from ChEMBL 36 via Core Engine