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Compound Detail

CHEMBL418183

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CCOP(=O)(CNC(C)=O)NC(Cc1ccccc1)NC(CCSC)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL418183
Phase Preclinical
Structure Type MOL
InChI Key HBPDXBYVKDZYAK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

431.5
MW (Da)
2.26
ALogP
6
HBA
4
HBD
116.8
PSA (Ų)
0.26
QED
0
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H30N3O5PS
MW 431.50
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine