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Compound Detail

CHEMBL1184585

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N=C(N)NCc1ccccc1-c1ccc(C(=O)NC[C@H](NS(=O)(=O)c2ccccc2)C(=O)O)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184585
Phase Preclinical
Structure Type MOL
InChI Key KAVRMLREXXGTPY-KRWDZBQOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

501.6
MW (Da)
1.56
ALogP
6
HBA
6
HBD
174.5
PSA (Ų)
0.18
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23N5O5S2
MW 501.59
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine