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Compound Detail

CHEMBL1183330

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O=C(N[C@H]1CCO[C@H]2CCC[C@@H](C(=O)O)N2C1=O)[C@@H](S)Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183330
Phase Preclinical
Structure Type MOL
InChI Key HRVHHYFZNPHCKO-VGWMRTNUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.5
MW (Da)
1.22
ALogP
5
HBA
3
HBD
95.9
PSA (Ų)
0.66
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 C19H24N2O5S
MW 392.48
Aromatic Rings 1
Heavy Atoms 27
NP-Likeness 0.02

Data from ChEMBL 36 via Core Engine