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Compound Detail

CHEMBL1187643

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CS(=O)(=O)NC(=O)c1ccc(-c2ccc(CCNC[C@H](O)c3ccccc3)cc2)cc1CC1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187643
Phase Preclinical
Structure Type MOL
InChI Key SQUQUNHXHNATKL-PMERELPUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

534.7
MW (Da)
5.03
ALogP
5
HBA
3
HBD
95.5
PSA (Ų)
0.30
QED
2
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H38N2O4S
MW 534.72
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -0.36

Data from ChEMBL 36 via Core Engine