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Compound Detail

CHEMBL1197137

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CC[C@@]1(N)C[C@@H]2SC[C@@H](C#N)N2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197137
Phase Preclinical
Structure Type MOL
InChI Key LNSMLCAQEMFRCV-BKPPORCPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

211.3
MW (Da)
0.29
ALogP
4
HBA
1
HBD
70.1
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H13N3OS
MW 211.29
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.04

Data from ChEMBL 36 via Core Engine