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Compound Detail

CHEMBL1187228

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N#C[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)N1CCc2ccsc2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187228
Phase Preclinical
Structure Type MOL
InChI Key FOPMZDZFMUZMNG-KBPBESRZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

346.5
MW (Da)
1.25
ALogP
5
HBA
1
HBD
90.4
PSA (Ų)
0.89
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 C17H22N4O2S
MW 346.46
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -1.05

Data from ChEMBL 36 via Core Engine