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Compound Detail

CHEMBL1620271

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COCCn1c(C)cc(C2=NN=C(NC3CC3)SC2)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1620271
Phase Preclinical
Structure Type MOL
InChI Key DEAXUHIMNFWQNN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

306.4
MW (Da)
2.31
ALogP
6
HBA
1
HBD
50.9
PSA (Ų)
0.91
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H22N4OS
MW 306.44
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -2.00

Data from ChEMBL 36 via Core Engine