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Compound Detail

CHEMBL1193204

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CCNc1nc2c(Cc3cccnc3)c(C)c(O)c(C)c2s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193204
Phase Preclinical
Structure Type MOL
InChI Key DGUIBKBFUIZIRY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

313.4
MW (Da)
4.04
ALogP
5
HBA
2
HBD
58.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H19N3OS
MW 313.43
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -0.67

Data from ChEMBL 36 via Core Engine