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Compound Detail

CHEMBL1194226

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CC1CCCc2c1sc1c2CN2C(=NC(=O)C2C)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194226
Phase Preclinical
Structure Type MOL
InChI Key KQGUGVRHFDKRTR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

275.4
MW (Da)
2.70
ALogP
4
HBA
1
HBD
44.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H17N3OS
MW 275.38
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.13

Data from ChEMBL 36 via Core Engine